General Information of the Compound
| Compound ID |
CP0542813
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| Compound Name |
5-(3-chlorophenyl)-4-(4-(4-methyl-1H-imidazol-5-yl)piperidin-1-yl)pyrimidine
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| Structure |
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| Formula |
C19H20ClN5
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| Molecular Weight |
353.857
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| Canonical SMILES |
Cc1nc[nH]c1C1CCN(CC1)c1ncncc1-c1cccc(Cl)c1
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| InChI |
InChI=1S/C19H20ClN5/c1-13-18(23-12-22-13)14-5-7-25(8-6-14)19-17(10-21-11-24-19)15-3-2-4-16(20)9-15/h2-4,9-12,14H,5-8H2,1H3,(H,22,23)
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| InChIKey |
TXEVILRPVNDVRU-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