General Information of the Compound
| Compound ID |
CP0203862
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| Compound Name |
N-cyclohexyl-1-(3-hydroxypropyl)-N-methyl-2-(thiophene-2-carbonylamino)benzimidazole-5-carboxamide
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| Structure |
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| Formula |
C23H28N4O3S
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| Molecular Weight |
440.569
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| Canonical SMILES |
CN(C1CCCCC1)C(=O)c1ccc2n(CCCO)c(NC(=O)c3cccs3)nc2c1
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| InChI |
InChI=1S/C23H28N4O3S/c1-26(17-7-3-2-4-8-17)22(30)16-10-11-19-18(15-16)24-23(27(19)12-6-13-28)25-21(29)20-9-5-14-31-20/h5,9-11,14-15,17,28H,2-4,6-8,12-13H2,1H3,(H,24,25,29)
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| InChIKey |
IVYRBVOBDZPTIK-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