General Information of the Compound
| Compound ID |
CP0402008
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| Compound Name |
3-(3-fluorophenylsulfonyl)-5-methoxy-1-(piperidin-3-yl)-1H-indole
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| Structure |
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| Formula |
C20H21FN2O3S
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| Molecular Weight |
388.464
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| Canonical SMILES |
COc1ccc2n(cc(c2c1)S(=O)(=O)c1cccc(F)c1)C1CCCNC1
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| InChI |
InChI=1S/C20H21FN2O3S/c1-26-16-7-8-19-18(11-16)20(13-23(19)15-5-3-9-22-12-15)27(24,25)17-6-2-4-14(21)10-17/h2,4,6-8,10-11,13,15,22H,3,5,9,12H2,1H3
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| InChIKey |
NFVSQUPZIYCBJF-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