General Information of the Compound
| Compound ID |
CP0485182
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| Compound Name |
N-[(1S,2S)-2-hydroxycyclohexyl]-1,6-dimethyl-2-oxo-5-[(4-pyrazol-1-ylphenyl)methyl]pyridine-3-carboxamide
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| Structure |
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| Formula |
C24H28N4O3
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| Molecular Weight |
420.513
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| Canonical SMILES |
Cc1c(Cc2ccc(cc2)-n2cccn2)cc(C(=O)N[C@H]2CCCC[C@@H]2O)c(=O)n1C
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| InChI |
InChI=1S/C24H28N4O3/c1-16-18(14-17-8-10-19(11-9-17)28-13-5-12-25-28)15-20(24(31)27(16)2)23(30)26-21-6-3-4-7-22(21)29/h5,8-13,15,21-22,29H,3-4,6-7,14H2,1-2H3,(H,26,30)/t21-,22-/m0/s1
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| InChIKey |
QWZSBBNDQSMMJM-VXKWHMMOSA-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