General Information of the Compound
| Compound ID |
CP0536774
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| Compound Name |
1-(benzenesulfonyl)-5-chloro-3-(2-methoxyphenyl)-3-(4-pyridin-3-ylpiperazin-1-yl)indol-2-one
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| Structure |
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| Formula |
C30H27ClN4O4S
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| Molecular Weight |
575.09
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| Canonical SMILES |
COc1ccccc1C1(N2CCN(CC2)c2cccnc2)C(=O)N(c2ccc(Cl)cc12)S(=O)(=O)c1ccccc1
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| InChI |
InChI=1S/C30H27ClN4O4S/c1-39-28-12-6-5-11-25(28)30(34-18-16-33(17-19-34)23-8-7-15-32-21-23)26-20-22(31)13-14-27(26)35(29(30)36)40(37,38)24-9-3-2-4-10-24/h2-15,20-21H,16-19H2,1H3
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| InChIKey |
CALAHTVXKGCDLP-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