CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00047439" 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 CFAMM00047439
Family CFFAD293 5-hydroxytryptamine receptor 3A Ligand Palonosetron Family
Superfamily CFSAD258 5-hydroxytryptamine receptor 3A Ligand Palonosetron Superfamily
Class CFCAD246 Class 246
External ID CHEMBL150609 External Source CHEMBL
PubChem CID 44367580 Functional Category Bioactive
Molecule Name AGN-PC-075SGV
IUPAC Name 4-[(4-benzylpiperazin-1-yl)-phenylmethyl]-N,N-diethylbenzamide;oxalic acid
Synonyms CHEBI:352845;4-[(4-benzylpiperazin-1-yl)-phenylmethyl]-N,N-diethylbenzamide;oxalic acid
InChi InChI=1S/C29H35N3O.C2H2O4/c1-3-31(4-2)29(33)27-17-15-26(16-18-27)28(25-13-9-6-10-14-25)32-21-19-30(20-22-32)23-24-11-7-5-8-12-24;3-1(4)2(5)6/h5-18,28H,3-4,19-23H2,1-2H3;(H,3,4)(H,5,6)
Formula C29H35N3O.C2H2O4 Molecular Weight 531.64
Cross Link CHEMBL150609

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



58234 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', 'CFAMM00047439'),None, txtsearch, CFAMM00047439|