General Information of the Compound
| Compound ID |
CP0442693
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| Compound Name |
3-[1-Benzenesulfonyl-2-(3-methoxybenzoyl)-1H-indol-5-yl]-Nhydroxyacrylamide
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| Structure |
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| Formula |
C25H20N2O6S
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| Molecular Weight |
476.51
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| Canonical SMILES |
COc1cccc(c1)C(=O)c1cc2cc(\C=C\C(=O)NO)ccc2n1S(=O)(=O)c1ccccc1
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| InChI |
InChI=1S/C25H20N2O6S/c1-33-20-7-5-6-18(15-20)25(29)23-16-19-14-17(11-13-24(28)26-30)10-12-22(19)27(23)34(31,32)21-8-3-2-4-9-21/h2-16,30H,1H3,(H,26,28)/b13-11+
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| InChIKey |
MVZPDGKOMFMAJV-ACCUITESSA-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