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You are searching for "CFAMM00190230" 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 | CFAMM00190230 |
| Family | CFFID385 Prothrombin Inhibitor LB30812 Family |
| Superfamily | CFSID7 Prothrombin and Neuropeptide Y receptor type 1 Binder Superfamily |
| Class | CFCID4 Class 1354 |
| External ID | DNC000864 |
External Source | TTD |
| PubChem CID |
56603775 |
Functional Category |
Investigative Drug |
| Molecule Name |
LB30812 |
| IUPAC Name |
(3R)-N-[(4-carbamimidoylphenyl)methyl]-1-[(2R)-3,3-diphenyl-2-(sulfamoylamino)propanoyl]pyrrolidine-3-carboxamide;2,2,2-trifluoroacetic acid |
| Synonyms |
LB30812 |
| InChi |
InChI=1S/C28H32N6O4S.C2HF3O2/c29-26(30)22-13-11-19(12-14-22)17-32-27(35)23-15-16-34(18-23)28(36)25(33-39(31,37)38)24(20-7-3-1-4-8-20)21-9-5-2-6-10-21;3-2(4,5)1(6)7/h1-14,23-25,33H,15-18H2,(H3,29,30)(H,32,35)(H2,31,37,38);(H,6,7)/t23-,25-;/m1./s1 |
| InChiKey |
RNDLEWFHHMPODL-ZHEQYFEDSA-N |
| Formula | C30H33F3N6O6S |
Molecular Weight | 662.68 |
| 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.
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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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