General Information of the Compound
| Compound ID |
CP0544485
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| Compound Name |
N-[6-chloro-3-(4-chlorophenyl)-2-oxo-1H-indol-3-yl]-2-(4-methylpiperazin-1-yl)acetamide
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| Structure |
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| Formula |
C21H22Cl2N4O2
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| Molecular Weight |
433.339
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| Canonical SMILES |
CN1CCN(CC(=O)NC2(C(=O)Nc3cc(Cl)ccc23)c2ccc(Cl)cc2)CC1
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| InChI |
InChI=1S/C21H22Cl2N4O2/c1-26-8-10-27(11-9-26)13-19(28)25-21(14-2-4-15(22)5-3-14)17-7-6-16(23)12-18(17)24-20(21)29/h2-7,12H,8-11,13H2,1H3,(H,24,29)(H,25,28)
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| InChIKey |
UVEJEVSQFOAZAP-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