CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00447756" 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 CFAMM00447756
Family CFFBM18494 P2Y purinoceptor 12 inhibitor (4S)-4-[[4-[(1-acetylpiperidin-4-yl)methoxy]-6-phenylpyridine-2-carbonyl]amino]-5-(4-butoxycarbonylpiperazin-1-yl)-5-oxopentanoic acid family
Superfamily CFSBM6134 P2Y purinoceptor 12 and C-C chemokine receptor type 5 Binder Superfamily
Class CFCCD105 Class 918
External ID CHEMBL592581 External Source CHEMBL
PubChem CID 45139950 Functional Category Bioactive
Molecule Name (4S)-5-(4-butoxycarbonylpiperazin-1-yl)-5-oxo-4-[[6-phenyl-4-(2-piperidin-2-ylethoxy)pyridine-2-carbonyl]amino]pentanoic acid
IUPAC Name (4S)-5-(4-butoxycarbonylpiperazin-1-yl)-5-oxo-4-[[6-phenyl-4-(2-piperidin-2-ylethoxy)pyridine-2-carbonyl]amino]pentanoic acid
Synonyms CHEBI:703761
InChi InChI=1S/C33H45N5O7/c1-2-3-20-45-33(43)38-18-16-37(17-19-38)32(42)27(12-13-30(39)40)36-31(41)29-23-26(44-21-14-25-11-7-8-15-34-25)22-28(35-29)24-9-5-4-6-10-24/h4-6,9-10,22-23,25,27,34H,2-3,7-8,11-21H2,1H3,(H,36,41)(H,39,40)/t25?,27-/m0/s1
Formula C33H45N5O7 Molecular Weight 623.74
Cross Link CHEMBL592581

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



106575 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', 'CFAMM00447756'),None, txtsearch, CFAMM00447756|