General Information of the Compound
| Compound ID |
CP0474493
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| Compound Name |
4-(5-(4-Chlorophenyl)-3-(5-fluoro-2-methoxybenzoyl)-2-methyl-1H-pyrrol-1-yl)benzenesulfonamide
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| Structure |
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| Formula |
C25H20ClFN2O4S
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| Molecular Weight |
498.963
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| Canonical SMILES |
COc1ccc(F)cc1C(=O)c1cc(-c2ccc(Cl)cc2)n(c1C)-c1ccc(cc1)S(N)(=O)=O
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| InChI |
InChI=1S/C25H20ClFN2O4S/c1-15-21(25(30)22-13-18(27)7-12-24(22)33-2)14-23(16-3-5-17(26)6-4-16)29(15)19-8-10-20(11-9-19)34(28,31)32/h3-14H,1-2H3,(H2,28,31,32)
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| InChIKey |
BVCWEXFYPSDGGF-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