Trade Names
Synonyms
Status
Molecule Category UNKNOWN
ATC D06AX14
UNII V0LH498RFO

Structure

InChI Key XPIJWUTXQAGSLK-UHFFFAOYSA-N
Smiles CNc1ncc(-c2ccc3c(=O)c(C(=O)O)cn(C4CC4)c3c2C)cc1C
InChI
InChI=1S/C21H21N3O3/c1-11-8-13(9-23-20(11)22-3)15-6-7-16-18(12(15)2)24(14-4-5-14)10-17(19(16)25)21(26)27/h6-10,14H,4-5H2,1-3H3,(H,22,23)(H,26,27)

Physicochemical Descriptors

Property Name Value
Molecular Formula C21H21N3O3
Molecular Weight 363.42
AlogP 3.76
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 4.0
Polar Surface Area 84.22
Molecular species ACID
Aromatic Rings 3.0
Heavy Atoms 27.0

Bioactivity

Mechanism of Action Action Reference
DNA gyrase inhibitor INHIBITOR FDA

Cross References

Resources Reference
ChEBI 136050
ChEMBL CHEMBL3990047
DrugBank DB12924
DrugCentral 5058
FDA SRS V0LH498RFO
Guide to Pharmacology 10841
PubChem 9863827
SureChEMBL SCHEMBL1711829
ZINC ZINC000001483896