General Information of the Compound
| Compound ID |
CP0411174
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| Compound Name |
3-(3-chlorophenylsulfonyl)-6-methoxy-1-(pyrrolidin-3-yl)-1H-indole
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| Structure |
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| Formula |
C19H19ClN2O3S
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| Molecular Weight |
390.892
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| Canonical SMILES |
COc1ccc2c(cn(C3CCNC3)c2c1)S(=O)(=O)c1cccc(Cl)c1
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| InChI |
InChI=1S/C19H19ClN2O3S/c1-25-15-5-6-17-18(10-15)22(14-7-8-21-11-14)12-19(17)26(23,24)16-4-2-3-13(20)9-16/h2-6,9-10,12,14,21H,7-8,11H2,1H3
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| InChIKey |
YJDWCWUZTZSLNC-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