General Information of the Compound
| Compound ID |
CP0411182
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| Compound Name |
1-(1-methylpiperidin-3-yl)-3-(naphthalen-1-ylsulfonyl)-1H-indole
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| Structure |
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| Formula |
C24H24N2O2S
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| Molecular Weight |
404.535
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| Canonical SMILES |
CN1CCCC(C1)n1cc(c2ccccc12)S(=O)(=O)c1cccc2ccccc12
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| InChI |
InChI=1S/C24H24N2O2S/c1-25-15-7-10-19(16-25)26-17-24(21-12-4-5-13-22(21)26)29(27,28)23-14-6-9-18-8-2-3-11-20(18)23/h2-6,8-9,11-14,17,19H,7,10,15-16H2,1H3
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| InChIKey |
CDXBGFFPULMAJJ-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