General Information of the Compound
| Compound ID |
CP0570263
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| Compound Name |
(1R,2R)-N-(1,3-dimethylpyrazol-4-yl)-2-[6-(1H-pyrazol-5-yl)pyridine-3-carbonyl]cyclohexane-1-carboxamide
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| Structure |
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| Formula |
C21H24N6O2
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| Molecular Weight |
392.463
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| Canonical SMILES |
Cc1nn(C)cc1NC(=O)[C@@H]1CCCC[C@H]1C(=O)c1ccc(nc1)-c1cc[nH]n1
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| InChI |
InChI=1S/C21H24N6O2/c1-13-19(12-27(2)26-13)24-21(29)16-6-4-3-5-15(16)20(28)14-7-8-17(22-11-14)18-9-10-23-25-18/h7-12,15-16H,3-6H2,1-2H3,(H,23,25)(H,24,29)/t15-,16-/m1/s1
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| InChIKey |
CGBOMWRTAFBZSY-HZPDHXFCSA-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