General Information of the Compound
| Compound ID |
CP0572548
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| Compound Name |
cyclopropyl-[3-[1-cyclopropyl-4-[2-[[2-(2-hydroxypropan-2-yl)pyridin-4-yl]amino]pyridin-4-yl]oxypyrazol-3-yl]azetidin-1-yl]methanone
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| Formula |
C26H30N6O3
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| Molecular Weight |
474.565
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| Canonical SMILES |
CC(C)(O)c1cc(Nc2cc(Oc3cn(nc3C3CN(C3)C(=O)C3CC3)C3CC3)ccn2)ccn1
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| InChI |
InChI=1S/C26H30N6O3/c1-26(2,34)22-11-18(7-9-27-22)29-23-12-20(8-10-28-23)35-21-15-32(19-5-6-19)30-24(21)17-13-31(14-17)25(33)16-3-4-16/h7-12,15-17,19,34H,3-6,13-14H2,1-2H3,(H,27,28,29)
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| InChIKey |
YSDVJOMIYLCUMP-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