General Information of the Compound
| Compound ID |
CP0523369
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| Compound Name |
N-[4,6-dichloro-3-(3,4-dichlorophenyl)-2-oxo-1H-indol-3-yl]-2-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]acetamide
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| Structure |
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| Formula |
C22H22Cl4N4O2
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| Molecular Weight |
516.256
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| Canonical SMILES |
CN(C)[C@H]1CCN(CC(=O)NC2(C(=O)Nc3cc(Cl)cc(Cl)c23)c2ccc(Cl)c(Cl)c2)C1
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| InChI |
InChI=1S/C22H22Cl4N4O2/c1-29(2)14-5-6-30(10-14)11-19(31)28-22(12-3-4-15(24)16(25)7-12)20-17(26)8-13(23)9-18(20)27-21(22)32/h3-4,7-9,14H,5-6,10-11H2,1-2H3,(H,27,32)(H,28,31)/t14-,22?/m0/s1
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| InChIKey |
KVYFVPXNWDGTIS-XLEXHMCLSA-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