General Information of the Compound
| Compound ID |
CP0917215
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| Compound Name |
(1S,5S)-cyclobutyl 3-(5-methyl-6-(2-methylpyridin-3-yloxy)pyrimidin-4-yloxy)-8-azabicyclo[3.2.1]octane-8-carboxylate
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| Formula |
C23H28N4O4
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| Molecular Weight |
424.501
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| Canonical SMILES |
Cc1ncccc1Oc1ncnc(O[C@H]2C[C@H]3CC[C@@H](C2)N3C(=O)OC2CCC2)c1C
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| InChI |
InChI=1S/C23H28N4O4/c1-14-21(25-13-26-22(14)31-20-7-4-10-24-15(20)2)29-19-11-16-8-9-17(12-19)27(16)23(28)30-18-5-3-6-18/h4,7,10,13,16-19H,3,5-6,8-9,11-12H2,1-2H3/t16-,17+,19+
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| InChIKey |
RDIQKPSJBZYAJM-DZFIZOCASA-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