General Information of the Compound
| Compound ID |
CP0536773
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| Compound Name |
5-chloro-1-(2,4-dimethoxyphenyl)sulfonyl-3-(2-methoxyphenyl)-3-(4-pyridin-3-ylpiperazin-1-yl)indol-2-one
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| Structure |
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| Formula |
C32H31ClN4O6S
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| Molecular Weight |
635.142
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| Canonical SMILES |
COc1ccc(c(OC)c1)S(=O)(=O)N1C(=O)C(N2CCN(CC2)c2cccnc2)(c2cc(Cl)ccc12)c1ccccc1OC
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| InChI |
InChI=1S/C32H31ClN4O6S/c1-41-24-11-13-30(29(20-24)43-3)44(39,40)37-27-12-10-22(33)19-26(27)32(31(37)38,25-8-4-5-9-28(25)42-2)36-17-15-35(16-18-36)23-7-6-14-34-21-23/h4-14,19-21H,15-18H2,1-3H3
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| InChIKey |
PFVLILTWOCGKRO-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