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You are searching for "CFAMM00388039" 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 | CFAMM00388039 |
| Family | CFFBM8451 Dipeptidyl peptidase 8 inhibitor (2S)-2-amino-4-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-1-(5-fluoro-1,3-dihydroisoindol-2-yl)butane-1,4-dione;2,2,2-trifluoroacetic acid family |
| Superfamily | CFSCD302 Substance-P receptor Ligand Orvepitant Superfamily |
| Class | CFCCD223 Class 1036 |
| External ID | CHEMBL1814750 |
External Source | CHEMBL |
| PubChem CID |
56671894 |
Functional Category |
Bioactive |
| Molecule Name |
(2S)-2-amino-4-[4-[bis(4-fluorophenyl)methyl]-3-oxopiperazin-1-yl]-1-(1,3-dihydroisoindol-2-yl)butane-1,4-dione;hydrochloride |
| IUPAC Name |
(2S)-2-amino-4-[4-[bis(4-fluorophenyl)methyl]-3-oxopiperazin-1-yl]-1-(1,3-dihydroisoindol-2-yl)butane-1,4-dione;hydrochloride |
| Synonyms |
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| InChi |
InChI=1S/C29H28F2N4O3.ClH/c30-23-9-5-19(6-10-23)28(20-7-11-24(31)12-8-20)35-14-13-33(18-27(35)37)26(36)15-25(32)29(38)34-16-21-3-1-2-4-22(21)17-34;/h1-12,25,28H,13-18,32H2;1H/t25-;/m0./s1 |
| InChiKey |
USXLYTBCCGXZFR-UQIIZPHYSA-N |
| Formula | C29H29ClF2N4O3 |
Molecular Weight | 555.02 |
| Cross Link | CHEMBL1814750 |
| 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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