Structure

InChI Key QRXWMOHMRWLFEY-UHFFFAOYSA-N
Smiles NNC(=O)c1ccncc1
InChI
InChI=1S/C6H7N3O/c7-9-6(10)5-1-3-8-4-2-5/h1-4H,7H2,(H,9,10)

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H7N3O
Molecular Weight 137.14
AlogP -0.31
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 1.0
Polar Surface Area 68.01
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 10.0

Metabolites Network

visNetwork

Bioactivity

Mechanism of Action Action Reference
Enoyl-[acyl-carrier-protein] reductase inhibitor INHIBITOR PubMed
Assay Description Organism Bioactivity Reference
Percent of enzyme inhibition by Glutamate decarboxylase assay method None 42.0 %
In vitro inhibition of Mycobacterium tuberculosis H37Rv, determined at 0.2 ug/mL Mycobacterium tuberculosis 49.7 %
In vitro inhibition of Mycobacterium tuberculosis H37Rv, determined at 2 ug/mL Mycobacterium tuberculosis 59.1 %
In vitro inhibition of Mycobacterium tuberculosis H37Rv, determined at 20 ug/mL Mycobacterium tuberculosis 68.7 %
Brain mitochondrial activity measured at 0 min of incubation at 1 uM concentration Rattus norvegicus 12.0 %
Brain mitochondrial activity measured at 0 min of incubation at 10 uM concentration Rattus norvegicus 14.0 %
Brain mitochondrial activity measured at 0 min of incubation at 100 uM concentration Rattus norvegicus 19.0 %
Brain mitochondrial activity measured at 120 min of incubation at 1 uM concentration Rattus norvegicus 16.0 %
Brain mitochondrial activity measured at 120 min of incubation at 10 uM concentration Rattus norvegicus 16.0 %
Brain mitochondrial activity measured at 120 min of incubation at 100 uM concentration Rattus norvegicus 22.0 %
Antimycobacterial activity of compound against Mycobacterium tuberculosis H37Rv at 0.05 ug/mL Mycobacterium tuberculosis 95.0 %
Cytotoxicity against Vero cell line Chlorocebus sabaeus 62.5 ug.mL-1
Antimycobacterial activity against Mycobacterium tuberculosis H37Rv by BACTEC-460 radiometric assay at 6.25 ug/ml Mycobacterium tuberculosis 96.0 %
Antimycobacterial activity against INH-resistant Mycobacterium tuberculosis by agar dilution method at 6.25 ug/ml Mycobacterium tuberculosis 90.0 %
Antimycobacterial activity against Mycobacterium tuberculosis H37Rv Mycobacterium tuberculosis 100.0 ug.mL-1
Toxicity against non-adherent human PBMC Homo sapiens 87.08 ug.mL-1
Toxicity against adherent human PBMC Homo sapiens 100.0 ug.mL-1
Antimycobacterial activity against drug-resistant Mycobacterium tuberculosis H37Rv at 1mg/mL by BACTEC assay Mycobacterium tuberculosis 100.0 %
Cytotoxicity against Vero cells after 48 hrs by XTT method Chlorocebus sabaeus 200.0 ug.mL-1
Inhibition of fatty acid synthesis in Mycobacterium bovis BCG after 60 mins Mycobacterium bovis BCG 4.0 ug.mL-1
Inhibition of alpha-mycolic acid synthesis in Mycobacterium bovis BCG after 60 mins Mycobacterium bovis BCG 1.851 ug.mL-1
Inhibition of methoxy-mycolic acid synthesis in Mycobacterium bovis BCG after 60 mins Mycobacterium bovis BCG 0.63 ug.mL-1
Inhibition of keto-mycolic acid synthesis in Mycobacterium bovis BCG after 60 mins Mycobacterium bovis BCG 0.69 ug.mL-1
Antimicrobial activity against Mycobacterium tuberculosis H37Rv at 6.25 ug/ml by alamar blue assay Mycobacterium tuberculosis 99.0 %
Antimycobacterial activity against Mycobacterium tuberculosis H37Rv ATCC 27294 at 6.25 ug/mL by radiometric method Mycobacterium tuberculosis H37Rv 99.0 %
Cytotoxicity against african green monkey Vero cells after 48 hrs by MTT assay Chlorocebus sabaeus 500.0 ug.mL-1
Antimicrobial activity against Mycobacterium tuberculosis H37Ra by microplate alamar blue assay Mycobacterium tuberculosis H37Ra 0.05 ug.mL-1
Antimycobacterial activity against Mycobacterium tuberculosis H37Rv ATCC 27294 at 6.25 ug/mL by BACTEC 460 radiometric assay Mycobacterium tuberculosis H37Rv 99.0 %
Inhibition of Mycobacterium membrane bound ATP synthase Mycobacterium 95.0 %
Cytotoxicity against african green monkey Vero cells after 72 hrs by MTT assay Chlorocebus sabaeus 62.5 ug.mL-1
Antitubercular activity against Mycobacterium tuberculosis H37Rv at MIC after 24 hrs by broth microdilution method Mycobacterium tuberculosis H37Rv 95.0 %
Cytotoxicity against african green monkey Vero cells after 72 hrs by MTT assay Chlorocebus sabaeus 62.5 ug.mL-1
Antimycobacterial activity against Mycobacterium tuberculosis H37Rv at 6.25 ug/ml by BACTEC 460 Mycobacterium tuberculosis H37Rv 99.0 %
Antimycobacterial activity against Mycobacterium tuberculosis H37Ra at 1 ug/ml after 6 days by microplate alamar blue assay Mycobacterium tuberculosis H37Ra 100.0 %
Antimycobacterial activity against rifampin-resistant Mycobacterium tuberculosis H37Rv at 1 ug/ml by radiometric BACTEC assay Mycobacterium tuberculosis H37Rv 100.0 %
Antimycobacterial activity against isoniazid-resistant Mycobacterium tuberculosis H37Rv at 2 ug/ml by radiometric BACTEC assay Mycobacterium tuberculosis H37Rv 0.0 %
Antituberculosis activity against Mycobacterium tuberculosis at MIC concentration after 7 days using resazurin dye by broth microdilution assay Mycobacterium tuberculosis 95.0 %
Antiinflammatory activity in rat assessed as inhibition of carrageenan-induced paw edema administered orally at dose equivalent to 70 mg/kg ibuprofen after 4 hrs Rattus norvegicus 51.62 %
Analgesic activity in po dosed mouse assessed as decrease in tail flick tendency after 4 hrs by tail flick test Mus musculus 45.9 %
Antitubercular activity against Mycobacterium bovis BCG at 1 ug/ml after 6 days by microplate alamar blue assay Mycobacterium bovis BCG 100.0 %
Antitubercular activity against Mycobacterium tuberculosis H37Ra at 1 ug/ml after 6 days by microplate alamar blue assay Mycobacterium tuberculosis H37Ra 100.0 %
Antimycobacterial activity against Mycobacterium tuberculosis after 24 hrs by MTT assay Mycobacterium tuberculosis 300.0 nM
Inhibition of Mycobacterium tuberculosis dihydrofolate reductase Mycobacterium tuberculosis 1.0 nM
Antimycobacterial activity against Mycobacterium tuberculosis H37Rv ATCC 27294 assessed as inhibition of bacterial growth at 1 to 100 ug/ml after 7 days by resazurin method Mycobacterium tuberculosis H37Rv 95.0 %
Inhibition of albino rat intestine alpha-glucosidase using p-nitrophenyl-alpha-D-glucopyranoside as substrate at 100 uM Rattus norvegicus -39.0 %
Antituberculosis activity against Mycobacterium tuberculosis H37Rv at 250 ug/mL after 24 hrs by Lowenstein-Jensen method Mycobacterium tuberculosis H37Rv 99.0 %
Antitubercular activity against Mycobacterium tuberculosis H37Rv infected in Swiss mouse assessed as inhibition of viable bacterial counts in lungs at 25 mg/kg, po for 28 days measured on day 30 post infection Mycobacterium tuberculosis H37Rv 99.98 %
Antimicrobial activity against Mycobacterium tuberculosis H37Rv in GASTD medium after 10 days by spectrophotometric analysis Mycobacterium tuberculosis H37Rv 70.0 nM
Antimicrobial activity against Mycobacterium tuberculosis H37Rv in GASTD medium supplemented with 100 uM FeCl3 after 10 days by spectrophotometric analysis Mycobacterium tuberculosis H37Rv 90.0 nM
Antituberculosis activity against Mycobacterium tuberculosis H37Rv at 6.25 ug/ml by BACTEC MGIT method Mycobacterium tuberculosis H37Rv 99.0 %
Growth inhibition of Mycobacterium tuberculosis H37Rv at 6.25 ug/mL after 12 to 28 days relative to control Mycobacterium tuberculosis H37Rv 99.0 %
Antitubercular activity against non-replicating Mycobacterium tuberculosis assessed as minimum concentration required to inhibit 90% growth after 10 days under anaerobic condition by luciferase-based low-oxygen recovery assay Mycobacterium tuberculosis 84.0 %
Cytotoxicity against african green monkey Vero cells after 72 hrs by MTT assay Chlorocebus sabaeus 62.5 ug.mL-1
Antimycobacterial activity against Mycobacterium tuberculosis H37Rv ATCC 27294 after 7 days by microplate alamar blue assay Mycobacterium tuberculosis H37Rv 92.0 %
Antimycobacterial activity against Mycobacterium tuberculosis H37Rv ATCC 27294 after 10 days by low oxygen recovery assay Mycobacterium tuberculosis H37Rv 64.0 %
Inhibition of human liver OATP1B1 expressed in HEK293 Flp-In cells assessed as reduction in E17-betaG uptake at 20 uM by scintillation counting Homo sapiens 29.9 %
Inhibition of human liver OATP1B3 expressed in HEK293 Flp-In cells assessed as reduction in [3H]E17-betaG uptake at 20 uM incubated for 5 mins by scintillation counting Homo sapiens 18.7 %
Inhibition of human liver OATP2B1 expressed in HEK293 Flp-In cells assessed as reduction in [3H]E3S uptake at 20 uM incubated for 5 mins by scintillation counting Homo sapiens 23.8 %
Antimycobacterial activity against Mycobacterium tuberculosis H37Rv ATCC 27294 after 7 days by Resazurin assay Mycobacterium tuberculosis H37Rv 95.0 %
Cytotoxicity against african green monkey Vero cells after 72 hrs by MTT assay Chlorocebus sabaeus 62.5 ug.mL-1
Antimicrobial activity against Mycobacterium tuberculosis H37Rv by BACTEC MGIT method Mycobacterium tuberculosis H37Rv 99.0 %
Antimicrobial activity against Mycobacterium tuberculosis H37Rv ATCC 27294 after 7 days by MABA Mycobacterium tuberculosis H37Rv 100.0 %
Cytotoxicity against Chlorocebus aethiops (African green monkey) Vero cells assessed as inhibition of cell viability after 96 hr by MTT assay Chlorocebus sabaeus 12.0 ug.mL-1
Antitubercular activity against Mycobacterium tuberculosis H37Rv MTCC 200 assessed as growth inhibition at 6.25 ug/ml by BACTEC MGIT method Mycobacterium tuberculosis H37Rv 99.0 %
Antitubercular activity against Mycobacterium tuberculosis H37Rv assessed as growth inhibition at <6.25 ug/ml by primary screen assay Mycobacterium tuberculosis H37Rv 99.0 %
Antimycobacterial activity against Mycobacterium tuberculosis H37Rv at 0.2 ug/ml Mycobacterium tuberculosis H37Rv 99.0 %
Cytotoxicity against african green monkey Vero cells after 72 hrs by MTT assay Chlorocebus sabaeus 62.5 ug.mL-1
Antitubercular activity against Mycobacterium tuberculosis H37Rv by BacTiter-Gl Microbial Cell Viability assay Mycobacterium tuberculosis H37Rv 130.0 nM
Antitubercular activity against Mycobacterium tuberculosis H37Rv by microdilution alamar Blue broth assay Mycobacterium tuberculosis H37Rv 190.0 nM
Antimycobacterial activity against Mycobacterium tuberculosis H37Rv Mycobacterium tuberculosis H37Rv 99.0 %
Cytotoxicity against african green monkey Vero cells after 72 hrs by MTS-PMS assay Chlorocebus sabaeus 100.0 ug.mL-1
Inhibition of Mycobacterium tuberculosis pantothenate synthetase cloned in Escherichia coli BL21 (DE3) using ATP, beta-alanine, pantoic acid as substrate assessed as NAD+ production at 100 uM measured every 12 secs for 120 secs by spectrophotometric analysis relative to control Mycobacterium tuberculosis 0.0 %
Inhibition of sodium fluorescein uptake in OATP1B1-transfected CHO cells at an equimolar substrate-inhibitor concentration of 10 uM Cricetulus griseus 88.4 %
Inhibition of sodium fluorescein uptake in OATP1B3-transfected CHO cells at an equimolar substrate-inhibitor concentration of 10 uM Cricetulus griseus 98.94 %
Antimicrobial activity against Mycobacterium tuberculosis H37Rv ATCC 27294 at 1 to 100 ug/ml after 7 days by resazurin assay Mycobacterium tuberculosis H37Rv 95.0 %
Antimicrobial activity against Mycobacterium tuberculosis H37Rv after 7 days by BacTiter-Glo assay Mycobacterium tuberculosis H37Rv 180.0 nM
Antituberculosis activity against Mycobacterium tuberculosis H37Rv ATCC 27294 assessed as inhibition of bacterial replication after 6 days by luminometry analysis Mycobacterium tuberculosis H37Rv 0.04 ug.mL-1
Antimycobacterial activity against Mycobacterium tuberculosis H37Rv assessed as growth inhibition by Alamar Blue staining-based broth microdilution assay Mycobacterium tuberculosis H37Rv 180.0 nM
Antimycobacterial activity against rifampin-resistant Mycobacterium tuberculosis H37Rv SRI 1367 at MIC after 7 days by broth microdilution assay relative to control Mycobacterium tuberculosis H37Rv 92.0 %
Antimycobacterial activity against Mycobacterium tuberculosis H37Rv ATCC 27294 after 7 days by microplate Alamar blue assay Mycobacterium tuberculosis H37Rv 0.18 ug.mL-1
Antimycobacterial activity against Mycobacterium tuberculosis H37Rv ATCC 27294 at 0.31 ug/ml after 7 days by microplate Alamar blue assay relative to control Mycobacterium tuberculosis H37Rv 92.9 %
Antimycobacterial activity against Mycobacterium tuberculosis H37Rv ATCC 27294 at 0.63 ug/ml after 7 days by microplate Alamar blue assay relative to control Mycobacterium tuberculosis H37Rv 93.9 %
Antimycobacterial activity against Mycobacterium tuberculosis H37Rv ATCC 27294 at 1.25 to 5 ug/ml after 7 days by microplate Alamar blue assay relative to control Mycobacterium tuberculosis H37Rv 94.0 %
Antimycobacterial activity against Mycobacterium tuberculosis H37Rv after 6 days by luciferase reporter gene assay Mycobacterium tuberculosis H37Rv 40.0 nM
Antitubercular activity against Mycobacterium tuberculosis H37Rv assessed as inhibition of colony formation at 250 ug/mL after 2 to 4 weeks by Lowensteine-Jensen method relative to control Mycobacterium tuberculosis H37Rv 99.0 %
Antitubercular activity against Mycobacterium tuberculosis H37Rv assessed as inhibition of colony formation at 100 ug/mL after 2 to 4 weeks by Lowensteine-Jensen method relative to control Mycobacterium tuberculosis H37Rv 99.0 %
Cytotoxicity against African green monkey Vero cells assessed as cell viability after 72 hrs by MTT assay Chlorocebus sabaeus 62.5 ug.mL-1
Antimycobacterial activity against Mycobacterium tuberculosis H37Rv by Lowenstein-Jensen slope method Mycobacterium tuberculosis H37Rv 99.0 %
Antitubercular activity against Mycobacterium tuberculosis H37Rv strain at 6.25 ug/ml by microplate alamar blue assay Mycobacterium tuberculosis H37Rv 99.0 %
Antitubercular activity against Mycobacterium tuberculosis H37Rv at 250 ug/ml Mycobacterium tuberculosis H37Rv 99.0 %
Inhibition of Mycobacterium tuberculosis H37Rv isocitrate lyase assessed as glyoxylate phenyl hydrazone formation at 10 uM Mycobacterium tuberculosis H37Rv 0.0 %
Antituberculosis activity against Mycobacterium tuberculosis H37Rv assessed as inhibition of colony formation at 250 ug/ml after 4 weeks of incubation Mycobacterium tuberculosis H37Rv 99.0 %
Antimycobacterial activity against Mycobacterium tuberculosis H37Rv assessed as growth inhibition by microdilution AlamarBlue broth assay Mycobacterium tuberculosis H37Rv 180.0 nM
Inhibition of Mycobacterium smegmatis TMC 607 ATP synthase at 0.3 uM incubated for 10 mins prior to NADH addition measured after 1 hr by luminescence assay Mycobacterium smegmatis 0.0 %
Inhibition of Mycobacterium tuberculosis H37Rv ATP synthase assessed as reduction in total ATP content at 0.5 ug/ml after 18 hrs by bead-vortexing settling method Mycobacterium tuberculosis H37Rv 78.5 %
Antimycobacterial activity against Mycobacterium tuberculosis H37Rv expressing Lux assessed as reduction in growth measured after 3 weeks by bioluminescence assay Mycobacterium tuberculosis H37Rv 330.0 nM
Antimycobacterial activity against Mycobacterium tuberculosis H37Rv infected in mouse bone-marrow derived macrophages assessed as reduction in intracellular colony forming units at 4 times antimycobacterial MIC measured during 3 hrs infection period relative to control Mycobacterium tuberculosis H37Rv 93.0 %
Antimycobacterial activity against Mycobacterium tuberculosis H37Rv infected in human blood monocyte derived macrophages assessed as reduction in intracellular colony forming units at 4 times antimycobacterial MIC measured during 3 hrs infection period relative to control Mycobacterium tuberculosis H37Rv 84.0 %
Cytotoxicity against PBMC (unknown origin) assessed as reduction in cell viability after 72 hrs by MTT assay Not specified 169.0 ug.mL-1
Cytotoxicity against mouse RAW264.7 cells assessed as reduction in cell viability after 72 hrs by MTT assay Mus musculus 400.0 ug.mL-1
Antimycobacterial activity against Mycobacterium tuberculosis H37Rv after 6 days by MTT assay Mycobacterium tuberculosis H37Rv 220.0 nM
Antimycobacterial activity against isoniazid-resistant Mycobacterium tuberculosis MYC5165 after 6 days by MTT assay Mycobacterium tuberculosis 650.0 nM
Antitubercular activity against Mycobacterium tuberculosis H37Rv ATCC 27294 at 6.25 ug/ml after 5 days by microplate Alamar Blue assay Mycobacterium tuberculosis H37Rv 100.0 %
Antitubercular activity against Mycobacterium tuberculosis H37Rv ATCC 27294 after 5 days by micro alamar blue assay Mycobacterium tuberculosis H37Rv 100.0 %
Anti-tubercular activity against rifampicin, isoniazid, ethambutol and pyrazinamide-sensitive dormant phage of Mycobacterium tuberculosis H37Ra ATCC 25177 by serial dilution method Mycobacterium tuberculosis H37Ra 0.0023 ug.mL-1
Anti-tubercular activity against rifampicin, isoniazid, ethambutol and pyrazinamide-sensitive active phage of Mycobacterium tuberculosis H37Ra ATCC 25177 by serial dilution method Mycobacterium tuberculosis H37Ra 0.0019 ug.mL-1
Anti-tubercular activity against rifampicin, isoniazid, ethambutol and pyrazinamide-sensitive dormant phage of Mycobacterium tuberculosis H37Ra ATCC 25177 infected in human THP1 cells by neutral red assay Mycobacterium tuberculosis H37Ra 0.0024 ug.mL-1
Anti-tubercular activity against rifampicin, isoniazid, ethambutol and pyrazinamide-sensitive active phage of Mycobacterium tuberculosis H37Ra ATCC 25177 infected in human THP1 cells by neutral red assay Mycobacterium tuberculosis H37Ra 0.0024 ug.mL-1
Antituberculosis activity against Mycobacterium tuberculosis H37Rv MTCC 300 at 6.25 ug/ml after 4 weeks by Lowenstein-Jensen medium method Mycobacterium tuberculosis H37Rv 99.0 %
Inhibition of tyrosinase in mouse B16F10 cells assessed as reduction of melanin production at 10 uM relative to control Mus musculus 104.0 %
Inhibition of tyrosinase in mouse B16F10 cells assessed as reduction of melanin production at 20 uM relative to control Mus musculus 100.0 %
Inhibition of tyrosinase in mouse B16F10 cells assessed as reduction of melanin production at 50 uM relative to control Mus musculus 102.0 %
Inhibition of tyrosinase in mouse B16F10 cell lysates using DOPA as substrate relative to control Mus musculus 97.0 %
Cytotoxicity against C57BL/6 mouse peritoneal macrophages assessed as cell viability by lactate dehydrogenase release assay Mus musculus 100.0 ug.mL-1
Antitubercular activity against Mycobacterium tuberculosis H37Ra ATCC 25177 by XTT Reduction Menadione Assay Mycobacterium tuberculosis H37Ra 0.0025 ug.mL-1
Antitubercular activity against Mycobacterium bovis BCG ATCC 35743 after 10 mins by NR assay Mycobacterium bovis BCG 0.0023 ug.mL-1
Antitubercular activity against active state Mycobacterium tuberculosis H37Ra assessed as viable cells after 8 days by XTT reduction menadione assay Mycobacterium tuberculosis H37Ra 0.0013 ug.mL-1
Antitubercular activity against dormant state Mycobacterium tuberculosis H37Ra assessed as viable cells after 12 days by XTT reduction menadione assay Mycobacterium tuberculosis H37Ra 0.0014 ug.mL-1
Antitubercular activity against active state Mycobacterium bovis BCG ATCC 35734 assessed as viable cells after 8 days by nitrate reductase assay Mycobacterium bovis BCG 0.0012 ug.mL-1
Antitubercular activity against dormant state Mycobacterium bovis BCG ATCC 35734 assessed as viable cells after 12 days by nitrate reductase assay Mycobacterium bovis BCG 0.0017 ug.mL-1
Antitubercular activity against dormant Mycobacterium bovis BCG ATCC 35743 by NR assay Mycobacterium bovis BCG str. ATCC 35743 0.0023 ug.mL-1
Antitubercular activity against dormant Mycobacterium tuberculosis H37Ra by XTT reduction menadione assay Mycobacterium tuberculosis H37Ra 0.0025 ug.mL-1
Antituberculosis activity against Mycobacterium tuberculosis H37Rv at 250 ug/ml incubated for 24 hrs measured after 2 to 4 weeks by Lowensteine-Jensen method Mycobacterium tuberculosis H37Rv 99.0 %
Antimycobacterial activity against rifampicin resistant Mycobacterium tuberculosis H37Rv ATCC 35838 at 1 ug/ml Mycobacterium tuberculosis H37Rv 100.0 %
Antimycobacterial activity against Mycobacterium tuberculosis H37Ra assessed as inhibition of mycobacterial replication at 0.05 ug/ml after 6 days by microplate Alamar blue assay in absence of isoniazid Mycobacterium tuberculosis H37Ra 10.0 %
Antitubercular activity against dormant Mycobacterium tuberculosis H37Ra after 12 days by XTT-Menadione assay Mycobacterium tuberculosis H37Ra 0.0025 ug.mL-1
Antitubercular activity against dormant Mycobacterium bovis BCG after 12 days by nitrate reductase assay Mycobacterium bovis BCG 0.0023 ug.mL-1
Antimicrobial activity against Mycobacterium tuberculosis H37Rv ATCC 27294 incubated for 7 days by BacTiter-Glo cell viability assay Mycobacterium tuberculosis H37Rv 100.0 nM
Cytotoxicity against mouse RAW264.7 cells assessed as inhibition of cell proliferation at 50 ug/ml after 48 hrs by MTT assay Mus musculus 12.16 %
Inhibition of Mycobacterium tuberculosis H37Ra infected in human THP1 cells assessed as reduction in surviving bacteria at 1 ug/ml after 7 days by serial dilution method Mycobacterium tuberculosis H37Ra 90.0 %
Inhibition of human MPO Homo sapiens 61.0 %
Antitubercular activity against Mycobacterium tuberculosis H37Rv at 6 ug/mL Mycobacterium tuberculosis H37Rv 99.0 %
Cytotoxicity against African green monkey Vero cells Chlorocebus sabaeus 256.0 ug.mL-1
Antimicrobial activity against Mycobacterium tuberculosis H37Rv by Alamar blue assay Mycobacterium tuberculosis H37Rv 180.0 nM
Cytotoxicity against monkey Vero cells assessed as decrease in cell viability after 72 hrs by MTT assay Chlorocebus sabaeus 6.25 ug.mL-1
Antitubercular activity against Mycobacterium tuberculosis H37Rv at 50 ug/ml after 5 days by microplate alamar blue assay relative to control Mycobacterium tuberculosis H37Rv 95.0 %
Antitubercular activity against Mycobacterium tuberculosis H37Rv at 100 ug/ml by broth microdilution method relative to control Mycobacterium tuberculosis H37Rv 99.0 %
Antitubercular activity against Mycobacterium tuberculosis H37Rv ATCC 27294 after 5 days under aerobic condition Mycobacterium tuberculosis H37Rv 131.0 nM
Antitubercular activity against luxABCDE expressing Mycobacterium tuberculosis H37Rv infected in human THP1 cells measured after 3 days by luminescence assay Mycobacterium tuberculosis H37Rv 190.0 nM
Cytotoxicity against African green monkey Vero cells assessed as reduction in cell viability after 72 hrs by MTT assay Chlorocebus sabaeus 200.0 ug.mL-1
Antimycobacterial activity against Mycobacterium tuberculosis H37Rv Mycobacterium tuberculosis H37Rv 120.0 nM
Antibacterial activity against Staphylococcus aureus MRSA ATCC 43300 (CO-ADD:GP_020); MIC in CAMBH media, using NBS plates, by OD(600) Staphylococcus aureus subsp. aureus 8.75 % Antibacterial activity against Staphylococcus aureus MRSA ATCC 43300 (CO-ADD:GP_020); MIC in CAMBH media, using NBS plates, by OD(600) Staphylococcus aureus subsp. aureus 27.38 %
Antibacterial activity against Escherichia coli ATCC 25922 (CO-ADD:GN_001); MIC in CAMBH media using NBS plates, by OD(600) Escherichia coli 0.87 % Antibacterial activity against Escherichia coli ATCC 25922 (CO-ADD:GN_001); MIC in CAMBH media using NBS plates, by OD(600) Escherichia coli 20.51 %
Antibacterial activity against Klebsiella pneumoniae MDR ATCC 70063 (CO-ADD:GN_003); MIC in CAMBH media using NBS plates, by OD(600) Klebsiella pneumoniae 6.54 % Antibacterial activity against Klebsiella pneumoniae MDR ATCC 70063 (CO-ADD:GN_003); MIC in CAMBH media using NBS plates, by OD(600) Klebsiella pneumoniae 18.82 %
Antibacterial activity against Pseudomonas aeruginosa ATCC 27853 (CO-ADD:GN_042); MIC in CAMBH media using NBS plates, by OD(600) Pseudomonas aeruginosa 1.16 % Antibacterial activity against Pseudomonas aeruginosa ATCC 27853 (CO-ADD:GN_042); MIC in CAMBH media using NBS plates, by OD(600) Pseudomonas aeruginosa 12.59 %
Antibacterial activity against Acinetobacter baumannii ATCC 19606 (CO-ADD:GN_034); MIC in CAMBH media using NBS plates, by OD600 Acinetobacter baumannii 18.82 % Antibacterial activity against Acinetobacter baumannii ATCC 19606 (CO-ADD:GN_034); MIC in CAMBH media using NBS plates, by OD600 Acinetobacter baumannii 7.52 %
Antifungal activity against Candida albicans ATCC 90028 (CO-ADD:FG_001); MIC in YNB media using NBS plates, by OD630 Candida albicans 3.95 % Antifungal activity against Candida albicans ATCC 90028 (CO-ADD:FG_001); MIC in YNB media using NBS plates, by OD630 Candida albicans 0.98 %
Antifungal activity against Cryptococcus neoformans H99 ATCC 208821 (CO-ADD:FG_002); MIC in YNB media using NBS plates, by Resazurin OD(600-570) Cryptococcus neoformans -3.6 % Antifungal activity against Cryptococcus neoformans H99 ATCC 208821 (CO-ADD:FG_002); MIC in YNB media using NBS plates, by Resazurin OD(600-570) Cryptococcus neoformans -55.93 %
Antiviral activity determined as inhibition of SARS-CoV-2 induced cytotoxicity of Caco-2 cells at 10 uM after 48 hours by high content imaging Homo sapiens 22.5 %
Cytotoxicity against human THP1 cells assessed as reduction in cell viability incubated for 48 hrs by MTT assay Homo sapiens 25.0 ug.mL-1
Antitubercular activity against Mycobacterium tuberculosis H37Ra ATCC 25177 harboring lux gene measured after 7 days by luminometric method Mycobacterium tuberculosis 210.0 nM
Antitubercular activity against Mycobacterium tuberculosis H37Ra ATCC 25177 transformed with pSMT1 luciferase reporter plasmid reduction in bacterial multiplication incubated for 7 days by luminometric assay Mycobacterium tuberculosis 210.0 nM
Antibacterial activity against Mycobacterium tuberculosis H37Ra ATCC 25177 incubated for 7 days by resazurin dye based fluorimetric assay Mycobacterium tuberculosis 250.0 nM
Antimycobacterial activity against Mycobacterium tuberculosis H37Ra lux incubated for 7 days by luminometric assay Mycobacterium tuberculosis 110.0 nM
Antimycobacterial activity activity against Mycobacterium tuberculosis H37Rv after 7 days by rezasurin-dye based spectrophotometric analysis Mycobacterium tuberculosis 100.0 nM
Antitubercular activity against Mycobacterium tuberculosis H37Rv assessed as reduction in viable colony forming unit at 1000 ug/ml incubated for 42 days by Lowensteine-Jensen method relative to control Mycobacterium tuberculosis 99.18 %
Inhibition of InhA in Mycobacterium tuberculosis H37Ra assessed as reduction in mycolic acids synthesis by measuring FAME level at 200 uM incubated for 48 hrs using [14C]acetate by TLC based metabolic labeling assay relative to control Mycobacterium tuberculosis H37Ra 100.0 %
Inhibition of InhA in Mycobacterium tuberculosis H37Ra assessed as reduction in mycolic acids synthesis by measuring MAME level at 200 uM incubated for 48 hrs using [14C]acetate by TLC based metabolic labeling assay relative to control Mycobacterium tuberculosis H37Ra 100.0 %
Inhibition of recombinant Mycobacterium tuberculosis H37Rv ICL1 expressed in Escherichia coli BL21 (DE3) cells at 10 uM using (+)-potassium Ds-threo-isocitrate as substrate by glyoxylate phenyl hydrazone formation assay relative to control Mycobacterium tuberculosis H37Rv 0.0 %
Inhibition of F0F1-ATP synthase in Mycobacterium tuberculosis H37Rv at 6.25 mg/ml using succinate as substrate preincubated for 10 mins followed by substrate addition by luciferase reporter gene assay relative to control Mycobacterium tuberculosis H37Rv 99.0 %
Antitubercular activity against Mycobacterium tuberculosis H37Rv RIF-R1 harboring nrpoB S522L mutant after 5 days Mycobacterium tuberculosis 150.0 nM
Antitubercular activity against Mycobacterium tuberculosis H37Rv RIF-R2 ATCC 35828 after 5 days Mycobacterium tuberculosis 540.0 nM
Antitubercular activity against Mycobacterium tuberculosis H37Rv FQ-R1 harboring gyrB D94N mutant after 5 days Mycobacterium tuberculosis 360.0 nM
SARS-CoV-2 3CL-Pro protease inhibition percentage at 20µM by FRET kind of response from peptide substrate Severe acute respiratory syndrome coronavirus 2 12.72 %
Antiviral activity determined as inhibition of SARS-CoV-2 induced cytotoxicity of VERO-6 cells at 10 uM after 48 hours exposure to 0.01 MOI SARS CoV-2 virus by high content imaging Chlorocebus sabaeus 0.12 % Antiviral activity determined as inhibition of SARS-CoV-2 induced cytotoxicity of VERO-6 cells at 10 uM after 48 hours exposure to 0.01 MOI SARS CoV-2 virus by high content imaging Chlorocebus sabaeus 0.12 %
Inhibition of PGL1 synthesis in Mycobacterium leprae infected Swiss Webster mouse macrophages assessed as decrease in [U-14C]PA incorporation at 20 uM preincubated for 4 days post infection followed by [U-14C]PA addition and measured after 7 days by liquid scintillation counter analysis relative to control Mycobacterium leprae 29.0 %
Inhibition of rat bone marrow myeloperoxidase using H2O2 as substrate at 10 uM after 20 mins by TMB based method (Rvb = - 1.4 +/- 12.7%) Rattus norvegicus 99.0 %
Inhibition of Electrophorus electricus AChE at 100 uM using acetylthiocholine iodide as substrate preincubated for 30 mins followed by substrate addition and measured after 10 mins by Ellman's method (Rvb = 7 +/- 7.1%) Electrophorus electricus 5.8 %
Antimycobacterial activity against Mycobacterium tuberculosis H37Rv assessed as inhibition of bacterial growth at 100 ug/ml preincubated for 72 hrs followed by phAE202 and Cacl2 addition and measured after 4 hrs by by luciferase reporter mycobacterio-phage assay Mycobacterium tuberculosis 99.0 %
Cytotoxicity against human PBMC assessed as reduction in cell growth after 72 hrs by MTT assay Homo sapiens 71.68 ug.mL-1
Antimycobacterial activity against Mycobacterium tuberculosis H37Rv assessed as inhibition of bacterial growth by microdilution alamar blue broth assay Mycobacterium tuberculosis 180.0 nM
Antimycobacterial activity against Mycobacterium tuberculosis H37Rv assessed as percentage inhibition at 250 ug/ml measured after 2 to 4 weeks by Lowensteine-Jensen method relative to control Mycobacterium tuberculosis 99.0 %
Antibacterial activity against Mycobacterium tuberculosis H37Ra ATCC2517 assessed as inhibition of bacterial growth measured after 17 hrs by resazurin based flourimetric assay Mycobacterium tuberculosis 100.0 nM
Antimycobacterial activity against Mycobacterium bovis BCG assessed as inhibition of bacterial growth at 1 ug/ml measured by microplate alamar blue assay Mycobacterium tuberculosis variant bovis BCG 100.0 %
Antimycobacterial activity against Mycobacterium tuberculosis H37Ra assessed as inhibition of bacterial growth at 1 ug/ml measured by microplate alamar blue assay Mycobacterium tuberculosis 100.0 %

Cross References

Resources Reference
ChEBI 6030
ChEMBL CHEMBL64
DrugBank DB00951
DrugCentral 1497
FDA SRS V83O1VOZ8L
Human Metabolome Database HMDB0015086
KEGG C07054
PDB NIZ
PharmGKB PA450112
PubChem 3767
SureChEMBL SCHEMBL228
ZINC ZINC000000001590