General Information of the Compound
| Compound ID |
CP0910119
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| Compound Name |
Benzyl-[5-(2-fluoro-benzyl)-2-pyridin-2-yl-pyrimidin-4-yl]-methyl-amine
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| Structure |
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| Formula |
C24H21FN4
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| Molecular Weight |
384.458
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| Canonical SMILES |
CN(Cc1ccccc1)c1nc(-c2ccccn2)ncc1Cc1ccccc1F
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| InChI |
InChI=1S/C24H21FN4/c1-29(17-18-9-3-2-4-10-18)24-20(15-19-11-5-6-12-21(19)25)16-27-23(28-24)22-13-7-8-14-26-22/h2-14,16H,15,17H2,1H3
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| InChIKey |
NYJCBQAOLQXNGV-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