General Information of the Compound
| Compound ID |
CP0415833
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| Compound Name |
[4-chloro-6-[4-(6-methoxypyridin-3-yl)oxypiperidin-1-yl]-5-methylpyrimidin-2-yl]methanol
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| Structure |
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| Formula |
C17H21ClN4O3
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| Molecular Weight |
364.833
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| Canonical SMILES |
COc1ccc(OC2CCN(CC2)c2nc(CO)nc(Cl)c2C)cn1
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| InChI |
InChI=1S/C17H21ClN4O3/c1-11-16(18)20-14(10-23)21-17(11)22-7-5-12(6-8-22)25-13-3-4-15(24-2)19-9-13/h3-4,9,12,23H,5-8,10H2,1-2H3
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| InChIKey |
KLOQNFVHWURQQJ-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