General Information of the Compound
| Compound ID |
CP0414913
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| Compound Name |
4-chloro-N-[3-(2-cyclopentyl-6-methyl-1,3-dioxopyrrolo[3,4-c]pyridin-4-yl)oxyphenyl]benzenesulfonamide
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| Structure |
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| Formula |
C25H22ClN3O5S
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| Molecular Weight |
511.987
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| Canonical SMILES |
Cc1cc2C(=O)N(C3CCCC3)C(=O)c2c(Oc2cccc(NS(=O)(=O)c3ccc(Cl)cc3)c2)n1
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| InChI |
InChI=1S/C25H22ClN3O5S/c1-15-13-21-22(25(31)29(24(21)30)18-6-2-3-7-18)23(27-15)34-19-8-4-5-17(14-19)28-35(32,33)20-11-9-16(26)10-12-20/h4-5,8-14,18,28H,2-3,6-7H2,1H3
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| InChIKey |
VAUXCDKWINZQLS-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