General Information of the Compound
| Compound ID |
CP0477513
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| Compound Name |
1-[(3-fluoro-4-methoxyphenyl)methyl]-N-(furan-2-ylmethyl)benzimidazol-2-amine
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| Structure |
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| Formula |
C20H18FN3O2
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| Molecular Weight |
351.381
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| Canonical SMILES |
COc1ccc(Cn2c(NCc3ccco3)nc3ccccc23)cc1F
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| InChI |
InChI=1S/C20H18FN3O2/c1-25-19-9-8-14(11-16(19)21)13-24-18-7-3-2-6-17(18)23-20(24)22-12-15-5-4-10-26-15/h2-11H,12-13H2,1H3,(H,22,23)
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| InChIKey |
GJKNVFZNTXRTIE-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