General Information of the Compound
| Compound ID |
CP0408933
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| Compound Name |
N-[3-(4-cyanophenyl)-1-ethylindol-6-yl]methanesulfonamide
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| Structure |
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| Formula |
C18H17N3O2S
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| Molecular Weight |
339.42
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| Canonical SMILES |
CCn1cc(-c2ccc(cc2)C#N)c2ccc(NS(C)(=O)=O)cc12
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| InChI |
InChI=1S/C18H17N3O2S/c1-3-21-12-17(14-6-4-13(11-19)5-7-14)16-9-8-15(10-18(16)21)20-24(2,22)23/h4-10,12,20H,3H2,1-2H3
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| InChIKey |
LSQKEQHYMWDEPS-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
Protein ID: PT00894, Androgen receptor
Protein ID: PT00967, Glucocorticoid receptor
Protein ID: PT01154, Mineralocorticoid receptor
Protein ID: PT01172, Progesterone receptor