CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00112546" 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 CFAMM00112546
Family CFFAD909 Nicotinic acetylcholine receptor Ligand Benztropine Mesylate Family
Superfamily CFSAD765 Nicotinic acetylcholine receptor Ligand Benztropine Mesylate Superfamily
Class CFCAD682 Class 682
External ID CHEMBL344083 External Source CHEMBL
PubChem CID 10504769 Functional Category Bioactive
Molecule Name (2S,5R)-1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-2,5-dimethyl-4-[(E)-3-phenylprop-2-enyl]piperazine
IUPAC Name (2S,5R)-1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-2,5-dimethyl-4-[(E)-3-phenylprop-2-enyl]piperazine
Synonyms CHEBI:336740
InChi InChI=1S/C30H34F2N2O/c1-23-22-34(24(2)21-33(23)18-6-9-25-7-4-3-5-8-25)19-20-35-30(26-10-14-28(31)15-11-26)27-12-16-29(32)17-13-27/h3-17,23-24,30H,18-22H2,1-2H3/b9-6+/t23-,24+/m1/s1
Formula C30H34F2N2O Molecular Weight 476.60
Cross Link CHEMBL344083

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



39264 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', 'CFAMM00112546'),None, txtsearch, CFAMM00112546|