CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00443347" 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.

Search Results

CFAM Mol ID CFAMM00443347
Family CFFBM17567 Leukotriene A-4 hydrolase inhibitor 4-[[(1S,5R)-3-[4-(2-fluorophenoxy)anilino]-8-azabicyclo[3.2.1]octan-8-yl]methyl]benzoic acid family
Superfamily CFSBM684 Leukotriene A-4 hydrolase and Matrix metalloproteinase-9 Binder Superfamily
Class CFCBM90 Class 3140
External ID CHEMBL471954 External Source CHEMBL
PubChem CID 44568089 Functional Category Bioactive
Molecule Name 4-[[(1S,5R)-3-[4-(2-fluorophenoxy)anilino]-8-azabicyclo[3.2.1]octan-8-yl]methyl]benzoic acid
IUPAC Name 4-[[(1S,5R)-3-[4-(2-fluorophenoxy)anilino]-8-azabicyclo[3.2.1]octan-8-yl]methyl]benzoic acid
Synonyms CHEBI:567524
InChi InChI=1S/C27H27FN2O3/c28-25-3-1-2-4-26(25)33-24-13-9-20(10-14-24)29-21-15-22-11-12-23(16-21)30(22)17-18-5-7-19(8-6-18)27(31)32/h1-10,13-14,21-23,29H,11-12,15-17H2,(H,31,32)/t21-,22+,23-
InChiKey UMIHWGFZSGUCOQ-NUNAXRQHSA-N
Formula C27H27FN2O3 Molecular Weight 446.51
Cross Link CHEMBL471954
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
 

 

27526 visits since 2014 .........

 



Dr. Chen Yuzong

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


All rights reserved.

   
 
 
Computer-aided Drug Design
about BIDD |  databases |  software |  teaching |  research |  links

 

Department of Computational Science | National University of Singapore | Blk S17, 3 Science Drive 2, Singapore 117543

hdnkeywordtype:MiniFieldStorage('hdnkeywordtype', 'compound'),None, hdnkeywordtype, compound|txtsearch:MiniFieldStorage('txtsearch', 'CFAMM00443347'),None, txtsearch, CFAMM00443347|