General Information of the Compound
| Compound ID |
CP0231172
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| Compound Name |
(4R)-4-methyl-2-oxo-N-[(1R)-1-phenylethyl]-1,3,4,5-tetrahydro-1,5-benzodiazepine-6-carboxamide
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| Structure |
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| Formula |
C19H21N3O2
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| Molecular Weight |
323.396
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| Canonical SMILES |
C[C@@H](NC(=O)c1cccc2NC(=O)C[C@@H](C)Nc12)c1ccccc1
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| InChI |
InChI=1S/C19H21N3O2/c1-12-11-17(23)22-16-10-6-9-15(18(16)20-12)19(24)21-13(2)14-7-4-3-5-8-14/h3-10,12-13,20H,11H2,1-2H3,(H,21,24)(H,22,23)/t12-,13-/m1/s1
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| InChIKey |
GHJLEIJLRPAVKG-CHWSQXEVSA-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