Trade Names
Synonyms
Status
Molecule Category Free-form
ATC L04AX06
UNII D2UX06XLB5
EPA CompTox DTXSID40893458

Structure

InChI Key UVSMNLNDYGZFPF-UHFFFAOYSA-N
Smiles Nc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
InChI
InChI=1S/C13H11N3O4/c14-7-3-1-2-6-10(7)13(20)16(12(6)19)8-4-5-9(17)15-11(8)18/h1-3,8H,4-5,14H2,(H,15,17,18)

Physicochemical Descriptors

Property Name Value
Molecular Formula C13H11N3O4
Molecular Weight 273.25
AlogP -0.33
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 1.0
Polar Surface Area 109.57
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 20.0

Pharmacology

Mechanism of Action Action Reference
CRL4(CRBN) E3 ubiquitin ligase inhibitor INHIBITOR PubMed PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Unclassified protein
22-24 - - 800 -
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Homo sapiens
8-27 13-230 157 - 21-95
Magnetospirillum gryphiswaldense
- - - 800 -
Rattus norvegicus
- - - - 5.5

Related Entries

Cross References

Resources Reference
ChEBI 72690
ChEMBL CHEMBL43452
DrugBank DB08910
DrugCentral 4746
FDA SRS D2UX06XLB5
Guide to Pharmacology 7348
PubChem 134780
SureChEMBL SCHEMBL19250920