General Information of the Compound
| Compound ID |
CP0402009
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| Compound Name |
3-(naphthalen-1-ylsulfonyl)-1-(piperidin-3-yl)-1H-indole
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| Structure |
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| Formula |
C23H22N2O2S
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| Molecular Weight |
390.508
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| Canonical SMILES |
O=S(=O)(c1cn(C2CCCNC2)c2ccccc12)c1cccc2ccccc12
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| InChI |
InChI=1S/C23H22N2O2S/c26-28(27,22-13-5-8-17-7-1-2-10-19(17)22)23-16-25(18-9-6-14-24-15-18)21-12-4-3-11-20(21)23/h1-5,7-8,10-13,16,18,24H,6,9,14-15H2
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| InChIKey |
LIBUOJHNQOIQIS-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