General Information of the Compound
| Compound ID |
CP0482757
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| Compound Name |
8-Methyl-6-(4-methyl-[1,4]diazepan-1-yl)-11H-benzo[e]pyrido[3,2-b][1,4]diazepine
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| Structure |
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| Formula |
C19H23N5
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| Molecular Weight |
321.428
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| Canonical SMILES |
CN1CCCN(CC1)C1=Nc2cccnc2Nc2ccc(C)cc12
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| InChI |
InChI=1S/C19H23N5/c1-14-6-7-16-15(13-14)19(24-10-4-9-23(2)11-12-24)22-17-5-3-8-20-18(17)21-16/h3,5-8,13H,4,9-12H2,1-2H3,(H,20,21)
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| InChIKey |
KTRNSFBDHMODHK-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