CFam Chemical Families Database
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You are searching for "CFAMM00439042" in compound.

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CFAM Mol ID CFAMM00439042
Family CFFBM16681 Somatostatin receptor type 1 and Somatostatin receptor type 2 ligand [(3R,4aR,10aR)-6-methoxy-1-methyl-3,4,4a,5,10,10a-hexahydro-2H-benzo[g]quinolin-3-yl]-(4-pyrido[2,3-b]pyrazin-6-ylpiperazin-1-yl)methanone family
Superfamily CFSBM6195 Somatostatin receptor type 1 and Somatostatin receptor type 2 Binder Superfamily 2
Class CFCAD227 Class 227
External ID CHEMBL1076715 External Source CHEMBL
PubChem CID 46880819 Functional Category Bioactive
Molecule Name AGN-PC-07ZA3E
IUPAC Name [2-[3-(1,3-benzodioxol-5-yl)-2-methylpropyl]-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-4-yl]-(4-pyrido[2,3-b]pyrazin-6-ylpiperazin-1-yl)methanone
Synonyms [2-[3-(1,3-benzodioxol-5-yl)-2-methylpropyl]-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-4-yl]-(4-pyrido[2,3-b]pyrazin-6-ylpiperazin-1-yl)methanone
InChi InChI=1S/C32H40N6O3/c1-22(16-23-6-8-28-29(17-23)41-21-40-28)18-36-19-24-4-2-3-5-25(24)26(20-36)32(39)38-14-12-37(13-15-38)30-9-7-27-31(35-30)34-11-10-33-27/h6-11,17,22,24-26H,2-5,12-16,18-21H2,1H3
InChiKey AIEPZCFSGUKURU-UHFFFAOYSA-N
Formula C32H40N6O3 Molecular Weight 556.70
Cross Link CHEMBL1076715
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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