CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00024457" in compound.

Total 1 results found.

Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00024457
Family CFFAD137 DNA topoisomerase 2-beta Inhibitor Gatifloxacin Family
Superfamily CFSAD128 DNA topoisomerase 2-beta Inhibitor Gatifloxacin Superfamily
Class CFCAD126 Class 126
External ID DNCL003528 External Source TTD
PubChem CID 11546234 Functional Category Clinical Trial Drug
Molecule Name Avarofloxacin
IUPAC Name 7-[(3E)-3-(2-amino-1-fluoroethylidene)piperidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid
Synonyms JNJ-Q2;Avarofloxacin (USAN);Avarofloxacin [USAN];878592-87-1;SureCN2190708;UNII-070SV15RJA;CHEMBL1257096;JNJ-32729463AAA;JNJ-32729463-AAA;D10435
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+
InChiKey VMKVDAAFMQKZJS-LFIBNONCSA-N
Formula C21H23F2N3O4 Molecular Weight 419.42
Cross Link CHEMBL1257096
Structure

Statistics of CFAM Database

 
CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.
 

How to cite our database

 
C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering. Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).
 

Last update by

 
2014.08.29
 

 

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Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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