CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00427175" 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 CFAMM00427175
Family CFFBM14219 Urotensin-2 receptor and Cytochrome P450 3A4 ligand 5-chloro-3-[2-oxo-2-[3-phenyl-2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethyl]-1,3-benzoxazol-2-one family
Superfamily CFSBM5358 Cruzipain and Prelamin-A/C Binder Superfamily 18
Class CFCBM1212 Class 4262
External ID CHEMBL498330 External Source CHEMBL
PubChem CID 44587040 Functional Category Bioactive
Molecule Name AGN-PC-077Q8Y
IUPAC Name 3-[4-[2-(5-chloro-2-oxo-1,3-benzoxazol-3-yl)acetyl]-3-(pyrrolidin-1-ylmethyl)piperazin-1-yl]sulfonylbenzonitrile
Synonyms CHEBI:610597;3-[4-[2-(5-chloro-2-oxo-1,3-benzoxazol-3-yl)acetyl]-3-(pyrrolidin-1-ylmethyl)piperazin-1-yl]sulfonylbenzonitrile
InChi InChI=1S/C25H26ClN5O5S/c26-19-6-7-23-22(13-19)31(25(33)36-23)17-24(32)30-11-10-29(16-20(30)15-28-8-1-2-9-28)37(34,35)21-5-3-4-18(12-21)14-27/h3-7,12-13,20H,1-2,8-11,15-17H2
Formula C25H26ClN5O5S Molecular Weight 544.02
Cross Link CHEMBL498330

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



27029 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', 'CFAMM00427175'),None, txtsearch, CFAMM00427175|