General Information of the Compound
| Compound ID |
CP0504398
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| Compound Name |
4-[[(Z)-3-oxo-3-(2-oxochromen-3-yl)prop-1-enyl]amino]-N-pyridin-2-ylbenzenesulfonamide
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| Structure |
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| Formula |
C23H17N3O5S
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| Molecular Weight |
447.472
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| Canonical SMILES |
O=C(\C=C/Nc1ccc(cc1)S(=O)(=O)Nc1ccccn1)c1cc2ccccc2oc1=O
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| InChI |
InChI=1S/C23H17N3O5S/c27-20(19-15-16-5-1-2-6-21(16)31-23(19)28)12-14-24-17-8-10-18(11-9-17)32(29,30)26-22-7-3-4-13-25-22/h1-15,24H,(H,25,26)/b14-12-
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| InChIKey |
RMTXMWZPERCICD-OWBHPGMISA-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