General Information of the Compound
| Compound ID |
CP0294578
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| Compound Name |
6-(3-chloro-6,11-dihydro-5H-benzo[b][1]benzazepin-8-yl)pyridine-2-carboxamide
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| Structure |
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| Formula |
C20H16ClN3O
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| Molecular Weight |
349.821
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| Canonical SMILES |
NC(=O)c1cccc(n1)-c1ccc2Nc3ccc(Cl)cc3CCc2c1
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| InChI |
InChI=1S/C20H16ClN3O/c21-15-7-9-18-14(11-15)5-4-12-10-13(6-8-17(12)23-18)16-2-1-3-19(24-16)20(22)25/h1-3,6-11,23H,4-5H2,(H2,22,25)
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| InChIKey |
DHGZFNINOOBXHZ-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