General Information of the Compound
| Compound ID |
CP0368111
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| Compound Name |
N-[5-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-2-methylphenyl]-2-methylquinoline-6-carboxamide
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| Structure |
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| Formula |
C26H23N3O5S
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| Molecular Weight |
489.553
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| Canonical SMILES |
Cc1ccc2cc(ccc2n1)C(=O)Nc1cc(NS(=O)(=O)c2ccc3OCCOc3c2)ccc1C
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| InChI |
InChI=1S/C26H23N3O5S/c1-16-3-7-20(29-35(31,32)21-8-10-24-25(15-21)34-12-11-33-24)14-23(16)28-26(30)19-6-9-22-18(13-19)5-4-17(2)27-22/h3-10,13-15,29H,11-12H2,1-2H3,(H,28,30)
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| InChIKey |
RBCXMERSSJSPCO-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