General Information of the Compound
| Compound ID |
CP0555127
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| Compound Name |
7-[5-methoxy-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)indol-1-yl]sulfonylquinoline
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| Structure |
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| Formula |
C24H23N3O3S
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| Molecular Weight |
433.533
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| Canonical SMILES |
COc1ccc2n(cc(C3=CCN(C)CC3)c2c1)S(=O)(=O)c1ccc2cccnc2c1
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| InChI |
InChI=1S/C24H23N3O3S/c1-26-12-9-17(10-13-26)22-16-27(24-8-6-19(30-2)14-21(22)24)31(28,29)20-7-5-18-4-3-11-25-23(18)15-20/h3-9,11,14-16H,10,12-13H2,1-2H3
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| InChIKey |
PDEQDXLELCXPRY-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