General Information of the Compound
| Compound ID |
CP0534381
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| Compound Name |
3-[(1S)-2-(4-chlorophenyl)-1-(1,6-dimethylbenzimidazol-2-yl)ethyl]-1-(4-phenoxyphenyl)imidazolidine-2,4-dione
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| Structure |
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| Formula |
C32H27ClN4O3
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| Molecular Weight |
551.046
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| Canonical SMILES |
Cc1ccc2nc([C@H](Cc3ccc(Cl)cc3)N3C(=O)CN(C3=O)c3ccc(Oc4ccccc4)cc3)n(C)c2c1
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| InChI |
InChI=1S/C32H27ClN4O3/c1-21-8-17-27-28(18-21)35(2)31(34-27)29(19-22-9-11-23(33)12-10-22)37-30(38)20-36(32(37)39)24-13-15-26(16-14-24)40-25-6-4-3-5-7-25/h3-18,29H,19-20H2,1-2H3/t29-/m0/s1
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| InChIKey |
MHAKJQWNTKWWJP-LJAQVGFWSA-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