General Information of the Compound
| Compound ID |
CP0362919
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| Compound Name |
1-[4-[[4-[1-cyclopropyl-3-(3,3-difluorocyclobutyl)pyrazol-4-yl]oxypyridin-2-yl]amino]pyridin-2-yl]-4-(trifluoromethyl)piperidin-4-ol
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| Formula |
C26H27F5N6O2
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| Molecular Weight |
550.532
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| Canonical SMILES |
OC1(CCN(CC1)c1cc(Nc2cc(Oc3cn(nc3C3CC(F)(F)C3)C3CC3)ccn2)ccn1)C(F)(F)F
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| InChI |
InChI=1S/C26H27F5N6O2/c27-25(28)13-16(14-25)23-20(15-37(35-23)18-1-2-18)39-19-4-8-32-21(12-19)34-17-3-7-33-22(11-17)36-9-5-24(38,6-10-36)26(29,30)31/h3-4,7-8,11-12,15-16,18,38H,1-2,5-6,9-10,13-14H2,(H,32,33,34)
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| InChIKey |
KISIXYFILRCUDO-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