General Information of the Compound
| Compound ID |
CP0425116
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| Compound Name |
4-[1-cyclopropyl-4-[2-[[2-(2-hydroxypropan-2-yl)pyridin-4-yl]amino]pyridin-4-yl]oxypyrazol-3-yl]-1-methylcyclohexan-1-ol
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| Structure |
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| Formula |
C26H33N5O3
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| Molecular Weight |
463.582
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| Canonical SMILES |
CC(C)(O)c1cc(Nc2cc(Oc3cn(nc3C3CCC(C)(O)CC3)C3CC3)ccn2)ccn1
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| InChI |
InChI=1S/C26H33N5O3/c1-25(2,32)22-14-18(8-12-27-22)29-23-15-20(9-13-28-23)34-21-16-31(19-4-5-19)30-24(21)17-6-10-26(3,33)11-7-17/h8-9,12-17,19,32-33H,4-7,10-11H2,1-3H3,(H,27,28,29)
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| InChIKey |
FCEXTMJJFAGZJM-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