General Information of the Compound
| Compound ID |
CP0427435
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| Compound Name |
5,6-dichloro-1-[1-(4-chlorophenyl)sulfonylpiperidin-4-yl]-N,N-dimethyl-2-(propan-2-ylamino)benzimidazole-4-carboxamide
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| Structure |
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| Formula |
C24H28Cl3N5O3S
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| Molecular Weight |
572.946
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| Canonical SMILES |
CC(C)Nc1nc2c(C(=O)N(C)C)c(Cl)c(Cl)cc2n1C1CCN(CC1)S(=O)(=O)c1ccc(Cl)cc1
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| InChI |
InChI=1S/C24H28Cl3N5O3S/c1-14(2)28-24-29-22-19(13-18(26)21(27)20(22)23(33)30(3)4)32(24)16-9-11-31(12-10-16)36(34,35)17-7-5-15(25)6-8-17/h5-8,13-14,16H,9-12H2,1-4H3,(H,28,29)
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| InChIKey |
BRZHJHAPMRPFRX-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