CFam Chemical Families Database
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You are searching for "CFAMM00446429" in compound.

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CFAM Mol ID CFAMM00446429
Family CFFBM18304 5-hydroxytryptamine receptor 4 ligand 2-oxo-N-[(1R,5S)-8-(2-piperidin-1-ylethyl)-8-azabicyclo[3.2.1]octan-3-yl]-1-propan-2-ylquinoline-3-carboxamide family
Superfamily CFSBM5128 Beta-lactamase and Cannabinoid receptor 2 Binder Superfamily 2
Class CFCBM1729 Class 4779
External ID ZINC02094107 External Source ZINC
PubChem CID 1750863 Functional Category Natural Product
Molecule Name (1R,5R)-N-((S)-1-((3,5-dimethylphenyl)amino)-3-methyl-1-oxobutan-2-yl)-8-oxo-4,5,6,8-tetrahydro-1H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(2H)-carboxamide
IUPAC Name
Synonyms MolPort-002-518-806;ZINC02094107
InChi InChI=1S/C25H32N4O3/c1-15(2)23(24(31)26-20-9-16(3)8-17(4)10-20)27-25(32)28-12-18-11-19(14-28)21-6-5-7-22(30)29(21)13-18/h5-10,15,18-19,23H,11-14H2,1-4H3,(H,26,31)(H,27,32)/t18-,19+,23+/m1/s1
InChiKey UGEBTXSSXQGUDS-MSYCTHLASA-N
Formula C25H32N4O3 Molecular Weight 436.55
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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