General Information of the Compound
| Compound ID |
CP0568651
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| Compound Name |
2-[(5-chloro-2-methoxybenzoyl)amino]-4-(4-chlorophenyl)thiophene-3-carboxylic acid
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| Structure |
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| Formula |
C19H13Cl2NO4S
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| Molecular Weight |
422.289
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| Canonical SMILES |
COc1ccc(Cl)cc1C(=O)Nc1scc(c1C(O)=O)-c1ccc(Cl)cc1
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| InChI |
InChI=1S/C19H13Cl2NO4S/c1-26-15-7-6-12(21)8-13(15)17(23)22-18-16(19(24)25)14(9-27-18)10-2-4-11(20)5-3-10/h2-9H,1H3,(H,22,23)(H,24,25)
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| InChIKey |
LGCXIMFLTYSQET-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