CFam Chemical Families Database
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You are searching for "CFAMM00332563" in compound.

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CFAM Mol ID CFAMM00332563
Family CFFBM2319 Neuronal acetylcholine receptor subunit alpha-7 and Acetylcholine-binding protein ligand 4-bromo-N-[(2S,3R)-2-(pyridin-3-ylmethyl)-1-azabicyclo[2.2.2]octan-3-yl]benzamide family
Superfamily CFSBM1290 Neuronal acetylcholine receptor subunit alpha-7 and Acetylcholine-binding protein ligand 4-bromo-N-[(2S,3R)-2-(pyridin-3-ylmethyl)-1-azabicyclo[2.2.2]octan-3-yl]benzamide Superfamily
Class CFCID141 Class 1491
External ID 18741088 External Source PubChem
PubChem CID 18741088 Functional Category Patent Compound
Molecule Name AGN-PC-020Q2O
IUPAC Name 1-[4-(3-bromo-8-methyl-11H-benzo[1,2]cyclohepta[2,4-b]pyridin-11-yl)piperazin-1-yl]-2-piperidin-4-ylethanone
Synonyms 1-[4-(3-bromo-8-methyl-11H-benzo[1,2]cyclohepta[2,4-b]pyridin-11-yl)piperazin-1-yl]-2-piperidin-4-ylethanone
InChi InChI=1S/C26H31BrN4O/c1-18-2-5-23-20(14-18)3-4-21-16-22(27)17-29-25(21)26(23)31-12-10-30(11-13-31)24(32)15-19-6-8-28-9-7-19/h2-5,14,16-17,19,26,28H,6-13,15H2,1H3
InChiKey BPABUEVTCWNVMK-UHFFFAOYSA-N
Formula C26H31BrN4O Molecular Weight 495.45
Cross Link
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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