General Information of the Compound
| Compound ID |
CP0449177
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| Compound Name |
cyclobutyl 6-[5-methyl-6-(2-methylpyridin-3-yl)oxypyrimidin-4-yl]-2,6-diazatricyclo[3.3.1.13,7]decane-2-carboxylate
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| Structure |
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| Formula |
C24H29N5O3
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| Molecular Weight |
435.528
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| Canonical SMILES |
Cc1ncccc1Oc1ncnc(N2C3CC4CC2CC(C3)N4C(=O)OC2CCC2)c1C
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| InChI |
InChI=1S/C24H29N5O3/c1-14-22(26-13-27-23(14)32-21-7-4-8-25-15(21)2)28-16-9-18-11-17(28)12-19(10-16)29(18)24(30)31-20-5-3-6-20/h4,7-8,13,16-20H,3,5-6,9-12H2,1-2H3
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| InChIKey |
QXAYQFDXSWMLCM-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