General Information of the Compound
| Compound ID |
CP0469068
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| Compound Name |
N-methyl-6-morpholin-4-yl-N-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)pyridine-3-carboxamide
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| Structure |
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| Formula |
C21H26N4O2
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| Molecular Weight |
366.465
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| Canonical SMILES |
CN(C(=O)c1ccc(nc1)N1CCOCC1)c1ccc2CCNCCc2c1
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| InChI |
InChI=1S/C21H26N4O2/c1-24(19-4-2-16-6-8-22-9-7-17(16)14-19)21(26)18-3-5-20(23-15-18)25-10-12-27-13-11-25/h2-5,14-15,22H,6-13H2,1H3
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| InChIKey |
VPVUZIRMFIXOHA-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