General Information of the Compound
| Compound ID |
CP0295902
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| Compound Name |
8-methyl-4-phenyl-1H-benzo[b][1,4]diazepin-2(3H)-one
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| Synonyms |
PMID25435285-Compound-25
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| Structure |
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| Formula |
C16H14N2O
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| Molecular Weight |
250.301
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| Canonical SMILES |
Cc1ccc2N=C(CC(=O)Nc2c1)c1ccccc1
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| InChI |
InChI=1S/C16H14N2O/c1-11-7-8-13-15(9-11)18-16(19)10-14(17-13)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,18,19)
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| InChIKey |
SCWDIXHHIUWDED-UHFFFAOYSA-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
Clinical Information about the Compound