CFam Chemical Families Database
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You are searching for "CFAMM00378919" in compound.

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CFAM Mol ID CFAMM00378919
Family CFFBM7307 Substance-K receptor and Substance-P receptor ligand N-[(2Z,3R)-5-[4-[3-(2-amino-2-oxoethyl)-2-oxopiperidin-1-yl]piperidin-1-yl]-3-(3,4-dichlorophenyl)-2-methoxyiminopentyl]-3,5-dichloro-N-methylbenzamide family
Superfamily CFSBM4080 Substance-K receptor and Substance-P receptor Binder Superfamily 7
Class CFCBM1486 Class 4536
External ID CHEMBL76437 External Source CHEMBL
PubChem CID 9917970 Functional Category Bioactive
Molecule Name 3,5-dichloro-N-[(2Z,3R)-3-(3,4-dichlorophenyl)-2-methoxyimino-5-[4-(2-oxo-3-propan-2-yl-1,3-diazinan-1-yl)piperidin-1-yl]pentyl]-N-methylbenzamide
IUPAC Name 3,5-dichloro-N-[(2Z,3R)-3-(3,4-dichlorophenyl)-2-methoxyimino-5-[4-(2-oxo-3-propan-2-yl-1,3-diazinan-1-yl)piperidin-1-yl]pentyl]-N-methylbenzamide
Synonyms CHEBI:222723
InChi InChI=1S/C32H41Cl4N5O3/c1-21(2)40-11-5-12-41(32(40)43)26-8-13-39(14-9-26)15-10-27(22-6-7-28(35)29(36)18-22)30(37-44-4)20-38(3)31(42)23-16-24(33)19-25(34)17-23/h6-7,16-19,21,26-27H,5,8-15,20H2,1-4H3/b37-30+/t27-/m1/s1
InChiKey NBJOVNZRQQUMDG-GANGTWLCSA-N
Formula C32H41Cl4N5O3 Molecular Weight 685.51
Cross Link CHEMBL76437
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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