General Information of the Compound
| Compound ID |
CP0392091
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| Compound Name |
N-[6-chloro-3-(3,4-dichlorophenyl)-5-methyl-2-oxo-1H-indol-3-yl]-2-(4-methylpiperazin-1-yl)acetamide
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| Structure |
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| Formula |
C22H23Cl3N4O2
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| Molecular Weight |
481.811
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| Canonical SMILES |
CN1CCN(CC(=O)NC2(C(=O)Nc3cc(Cl)c(C)cc23)c2ccc(Cl)c(Cl)c2)CC1
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| InChI |
InChI=1S/C22H23Cl3N4O2/c1-13-9-15-19(11-17(13)24)26-21(31)22(15,14-3-4-16(23)18(25)10-14)27-20(30)12-29-7-5-28(2)6-8-29/h3-4,9-11H,5-8,12H2,1-2H3,(H,26,31)(H,27,30)
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| InChIKey |
URCLPMINPINWRM-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