General Information of the Compound
| Compound ID |
CP0495880
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| Compound Name |
N-methyl-N-(1-methylpiperidin-4-yl)-1-(3-methylquinolin-8-yl)sulfonyl-2,3-dihydroindole-3-carboxamide
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| Structure |
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| Formula |
C26H30N4O3S
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| Molecular Weight |
478.618
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| Canonical SMILES |
CN(C1CCN(C)CC1)C(=O)C1CN(c2ccccc12)S(=O)(=O)c1cccc2cc(C)cnc12
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| InChI |
InChI=1S/C26H30N4O3S/c1-18-15-19-7-6-10-24(25(19)27-16-18)34(32,33)30-17-22(21-8-4-5-9-23(21)30)26(31)29(3)20-11-13-28(2)14-12-20/h4-10,15-16,20,22H,11-14,17H2,1-3H3
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| InChIKey |
VVFPEFIJIGGTGQ-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