General Information of the Compound
| Compound ID |
CP0422111
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| Compound Name |
5-fluoro-3-(3-fluorophenylsulfonyl)-1-(1-methylpyrrolidin-3-yl)-1H-indole
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| Structure |
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| Formula |
C19H18F2N2O2S
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| Molecular Weight |
376.428
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| Canonical SMILES |
CN1CCC(C1)n1cc(c2cc(F)ccc12)S(=O)(=O)c1cccc(F)c1
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| InChI |
InChI=1S/C19H18F2N2O2S/c1-22-8-7-15(11-22)23-12-19(17-10-14(21)5-6-18(17)23)26(24,25)16-4-2-3-13(20)9-16/h2-6,9-10,12,15H,7-8,11H2,1H3
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| InChIKey |
VQKUYLJQGPKXQK-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