General Information of the Compound
| Compound ID |
CP0553477
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| Compound Name |
2-(4-benzylpiperazin-1-yl)-N-[6-chloro-3-(4-chlorophenyl)-5-methyl-2-oxo-1H-indol-3-yl]acetamide
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| Structure |
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| Formula |
C28H28Cl2N4O2
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| Molecular Weight |
523.464
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| Canonical SMILES |
Cc1cc2c(NC(=O)C2(NC(=O)CN2CCN(Cc3ccccc3)CC2)c2ccc(Cl)cc2)cc1Cl
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| InChI |
InChI=1S/C28H28Cl2N4O2/c1-19-15-23-25(16-24(19)30)31-27(36)28(23,21-7-9-22(29)10-8-21)32-26(35)18-34-13-11-33(12-14-34)17-20-5-3-2-4-6-20/h2-10,15-16H,11-14,17-18H2,1H3,(H,31,36)(H,32,35)
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| InChIKey |
ULBOTVBVADVBLN-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