CFam Chemical Families Database
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You are searching for "CFAMM00331559" 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.

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CFAM Mol ID CFAMM00331559
Family CFFBM2225 D(3) dopamine receptor and D(2) dopamine receptor ligand (E)-3-(1,3-benzodioxol-4-yl)-N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]prop-2-enamide family
Superfamily CFSBM1241 Prelamin-A/C and Menin Binder Superfamily 2
Class CFCBM207 Class 3257
External ID CHEMBL125459 External Source CHEMBL
PubChem CID 11102188 Functional Category Bioactive
Molecule Name (E)-3-(1,3-benzodioxol-4-yl)-N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]prop-2-enamide
IUPAC Name (E)-3-(1,3-benzodioxol-4-yl)-N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]prop-2-enamide
Synonyms CHEBI:310222
InChi InChI=1S/C25H31N3O4/c1-30-22-9-3-2-8-21(22)28-17-15-27(16-18-28)14-5-4-13-26-24(29)12-11-20-7-6-10-23-25(20)32-19-31-23/h2-3,6-12H,4-5,13-19H2,1H3,(H,26,29)/b12-11+
InChiKey UGPOUXCBUMYZLN-VAWYXSNFSA-N
Formula C25H31N3O4 Molecular Weight 437.53
Cross Link CHEMBL125459
Structure

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

 
2014.08.29
 

 

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Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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