AVAROFLOXACIN

Search structure
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 070SV15RJA

Structure
InChI Key VMKVDAAFMQKZJS-LFIBNONCSA-N
Smile COc1c(N2CCC/C(=C(\F)CN)C2)c(F)cc2c(=O)c(C(=O)O)cn(C3CC3)c12
InChI
InChI=1S/C21H23F2N3O4/c1-30-20-17-13(19(27)14(21(28)29)10-26(17)12-4-5-12)7-15(22)18(20)25-6-2-3-11(9-25)16(23)8-24/h7,10,12H,2-6,8-9,24H2,1H3,(H,28,29)/b16-11+

Physicochemical Descriptors

Property Name Value
Molecular Formula C21H23F2N3O4
Molecular Weight 419.43
AlogP 2.96
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 5.0
Polar Surface Area 97.79
Molecular species ACID
Aromatic Rings 2.0
Heavy Atoms 30.0

Related Entries

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL1257096
EPA CompTox DTXSID20236667
FDA SRS 070SV15RJA
Guide to Pharmacology 10753
PubChem 11546234
SureChEMBL SCHEMBL2190708
ZINC ZINC000034661474
CONTENTS