General Information of the Compound
| Compound ID |
CP0356939
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| Compound Name |
2-[4-[[4-[1-cyclopropyl-3-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazol-4-yl]oxypyridin-2-yl]amino]pyridin-2-yl]propan-2-ol
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| Formula |
C24H26N6O3
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| Molecular Weight |
446.511
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| Canonical SMILES |
Cc1noc(C)c1-c1nn(cc1Oc1ccnc(Nc2ccnc(c2)C(C)(C)O)c1)C1CC1
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| InChI |
InChI=1S/C24H26N6O3/c1-14-22(15(2)33-29-14)23-19(13-30(28-23)17-5-6-17)32-18-8-10-26-21(12-18)27-16-7-9-25-20(11-16)24(3,4)31/h7-13,17,31H,5-6H2,1-4H3,(H,25,26,27)
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| InChIKey |
HAFVCEITTXVVHR-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