General Information of the Compound
| Compound ID |
CP0427900
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| Compound Name |
1-(4-fluorobenzyl)-N-(1-(3-phenylpropyl)piperidin-4-yl)-1H-benzo[d]imidazol-2-amine
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| Structure |
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| Formula |
C28H31FN4
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| Molecular Weight |
442.582
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| Canonical SMILES |
Fc1ccc(Cn2c(NC3CCN(CCCc4ccccc4)CC3)nc3ccccc23)cc1
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| InChI |
InChI=1S/C28H31FN4/c29-24-14-12-23(13-15-24)21-33-27-11-5-4-10-26(27)31-28(33)30-25-16-19-32(20-17-25)18-6-9-22-7-2-1-3-8-22/h1-5,7-8,10-15,25H,6,9,16-21H2,(H,30,31)
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| InChIKey |
BQXNKIUNSHZBLU-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