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You are searching for "CFAMM00135314" 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.
| CFAM Mol ID | CFAMM00135314 |
| Family | CFFCD122 Neuromedin-K receptor Ligand Osanetant Family |
| Superfamily | CFSCD111 Neuromedin-K receptor Ligand Osanetant Superfamily |
| Class | CFCCD95 Class 908 |
| External ID | CHEMBL109053 |
External Source | CHEMBL |
| PubChem CID |
44337202 |
Functional Category |
Bioactive |
| Molecule Name |
2-[(1-benzylpiperidin-4-yl)amino]-1-[(2R)-4-[3,5-bis(trifluoromethyl)benzoyl]-2-(3,4-dichlorophenyl)piperazin-1-yl]ethanone |
| IUPAC Name |
2-[(1-benzylpiperidin-4-yl)amino]-1-[(2R)-4-[3,5-bis(trifluoromethyl)benzoyl]-2-(3,4-dichlorophenyl)piperazin-1-yl]ethanone |
| Synonyms |
CHEBI:276138 |
| InChi |
InChI=1S/C33H32Cl2F6N4O2/c34-27-7-6-22(16-28(27)35)29-20-44(31(47)23-14-24(32(36,37)38)17-25(15-23)33(39,40)41)12-13-45(29)30(46)18-42-26-8-10-43(11-9-26)19-21-4-2-1-3-5-21/h1-7,14-17,26,29,42H,8-13,18-20H2/t29-/m0/s1 |
| InChiKey |
WSYQSMJFBSIBRN-LJAQVGFWSA-N |
| Formula | C33H32Cl2F6N4O2 |
Molecular Weight | 701.53 |
| Cross Link | CHEMBL109053 |
| Structure |
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Statistics of CFAM Database |
CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.
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How to cite our database |
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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).
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Last update by |
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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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