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You are searching for "CFAMM00376645" 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 | CFAMM00376645 |
Family | CFFBM7035 RAC-alpha serine/threonine-protein kinase inhibitor 2-[(3,4-difluorophenyl)methyl]-1-[4-[(5S)-5-methyl-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]piperazin-1-yl]-3-(propan-2-ylamino)propan-1-one family |
Superfamily | CFSBM4004 Mitogen-activated protein kinase 9 and Mitogen-activated protein kinase 8 Binder Superfamily |
Class | CFCBM1469 Class 4519 |
External ID | ZINC13569430 |
External Source | ZINC |
PubChem CID |
51524205 |
Functional Category |
Natural Product |
Molecule Name |
2-(4-fluorophenyl)-N-[(2S)-4-methylsulfanyl-1-oxo-1-spiro[1,5,6,7-tetrahydroimidazo[4,5-c]pyridin-3-ium-4,4'-piperidine]-1'-ylbutan-2-yl]acetamide |
IUPAC Name |
2-(4-fluorophenyl)-N-[(2S)-4-methylsulfanyl-1-oxo-1-spiro[1,5,6,7-tetrahydroimidazo[4,5-c]pyridin-3-ium-4,4'-piperidine]-1'-ylbutan-2-yl]acetamide |
Synonyms |
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InChi |
InChI=1S/C23H30FN5O2S/c1-32-13-7-19(28-20(30)14-16-2-4-17(24)5-3-16)22(31)29-11-8-23(9-12-29)21-18(6-10-27-23)25-15-26-21/h2-5,15,19,27H,6-14H2,1H3,(H,25,26)(H,28,30)/p+1/t19-/m0/s1 |
InChiKey |
KQOFFOBKIXVTCK-IBGZPJMESA-O |
Formula | C23H31FN5O2S+ |
Molecular Weight | 460.59 |
Cross Link | |
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. |
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).
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Last update by |
2014.08.29
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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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