General Information of the Compound
| Compound ID |
CP0494154
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| Compound Name |
7-[2-methyl-3-(1,2,3,6-tetrahydropyridin-4-yl)indol-1-yl]sulfonylquinoline
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| Structure |
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| Formula |
C23H21N3O2S
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| Molecular Weight |
403.507
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| Canonical SMILES |
Cc1c(C2=CCNCC2)c2ccccc2n1S(=O)(=O)c1ccc2cccnc2c1
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| InChI |
InChI=1S/C23H21N3O2S/c1-16-23(18-10-13-24-14-11-18)20-6-2-3-7-22(20)26(16)29(27,28)19-9-8-17-5-4-12-25-21(17)15-19/h2-10,12,15,24H,11,13-14H2,1H3
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| InChIKey |
HGXWCCFSHHOHSI-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