General Information of the Compound
| Compound ID |
CP0430479
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| Compound Name |
Benzyl-{4-[4-(4-fluoro-phenyl)-5-pyridin-4-yl-1H-imidazol-2-yl]-benzyl}-methyl-amine
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| Structure |
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| Formula |
C29H25FN4
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| Molecular Weight |
448.545
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| Canonical SMILES |
CN(Cc1ccccc1)Cc1ccc(cc1)-c1nc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1
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| InChI |
InChI=1S/C29H25FN4/c1-34(19-21-5-3-2-4-6-21)20-22-7-9-25(10-8-22)29-32-27(23-11-13-26(30)14-12-23)28(33-29)24-15-17-31-18-16-24/h2-18H,19-20H2,1H3,(H,32,33)
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| InChIKey |
FMWMUCWMTIOHOR-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