General Information of the Compound
| Compound ID |
CP0557230
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| Compound Name |
N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(5R)-6,7-dihydro-5H-cyclopenta[b]pyridin-5-yl]benzamide
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| Structure |
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| Formula |
C23H21N3O2
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| Molecular Weight |
371.44
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| Canonical SMILES |
NC(=O)[C@H](N([C@@H]1CCc2ncccc12)C(=O)c1ccccc1)c1ccccc1
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| InChI |
InChI=1S/C23H21N3O2/c24-22(27)21(16-8-3-1-4-9-16)26(23(28)17-10-5-2-6-11-17)20-14-13-19-18(20)12-7-15-25-19/h1-12,15,20-21H,13-14H2,(H2,24,27)/t20-,21-/m1/s1
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| InChIKey |
XBABMNGTOUFRFD-NHCUHLMSSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound