General Information of the Compound
| Compound ID |
CP0537568
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| Compound Name |
N-[[4-(6-fluoropyridin-3-yl)phenyl]methyl]-5-methoxy-1H-indole-2-sulfonamide
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| Structure |
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| Formula |
C21H18FN3O3S
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| Molecular Weight |
411.458
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| Canonical SMILES |
COc1ccc2[nH]c(cc2c1)S(=O)(=O)NCc1ccc(cc1)-c1ccc(F)nc1
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| InChI |
InChI=1S/C21H18FN3O3S/c1-28-18-7-8-19-17(10-18)11-21(25-19)29(26,27)24-12-14-2-4-15(5-3-14)16-6-9-20(22)23-13-16/h2-11,13,24-25H,12H2,1H3
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| InChIKey |
PTHGJGJQBDBZRX-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