General Information of the Compound
| Compound ID |
CP0910120
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| Compound Name |
4-Chloro-5-(2-fluoro-benzyl)-2-pyridin-2-yl-pyrimidine
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| Structure |
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| Formula |
C16H11ClFN3
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| Molecular Weight |
299.736
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| Canonical SMILES |
Fc1ccccc1Cc1cnc(-c2ccccn2)nc1Cl
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| InChI |
InChI=1S/C16H11ClFN3/c17-15-12(9-11-5-1-2-6-13(11)18)10-20-16(21-15)14-7-3-4-8-19-14/h1-8,10H,9H2
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| InChIKey |
AYXVZQKOIAPWOY-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