CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00072123" 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 CFAMM00072123
Family CFFAD519 Multidrug resistance protein Inhibitor Benzquinamide Family
Superfamily CFSAD451 ABC transporter inhibitor Benzquinamide, amine transporter inhibitor Tetrabenazine Superfamily
Class CFCAD92 Class 92
External ID CHEMBL70124 External Source CHEMBL
PubChem CID 456319 Functional Category Bioactive
Molecule Name AC1L9UOR
IUPAC Name [4-[(3S)-4-[(1S)-1-[4-(1,3-benzodioxol-5-ylmethyl)phenyl]ethyl]-3-methylpiperazin-1-yl]piperidin-1-yl]-(2-methylphenyl)methanone
Synonyms CHEBI:206181;[4-[(3S)-4-[(1S)-1-[4-(1,3-benzodioxol-5-ylmethyl)phenyl]ethyl]-3-methylpiperazin-1-yl]piperidin-1-yl]-(2-methylphenyl)methanone;Piperazine, 1-[(1S)-1-[4-(1,3-benzodioxol-5-ylmethyl)phenyl]ethyl]-2-methyl-4-[1-(2-methylbenzoyl)-4-piperidinyl]-, (2S)-
InChi InChI=1S/C34H41N3O3/c1-24-6-4-5-7-31(24)34(38)35-16-14-30(15-17-35)36-18-19-37(25(2)22-36)26(3)29-11-8-27(9-12-29)20-28-10-13-32-33(21-28)40-23-39-32/h4-13,21,25-26,30H,14-20,22-23H2,1-3H3/t25-,26-/m0/s1
Formula C34H41N3O3 Molecular Weight 539.71
Cross Link CHEMBL70124

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



106297 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', 'CFAMM00072123'),None, txtsearch, CFAMM00072123|