General Information of the Compound
| Compound ID |
CP0471388
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| Compound Name |
1-(4-fluorobenzyl)-N-(1-((1,2,3,4-tetrahydronaphthalen-2-yl)methyl)piperidin-4-yl)-1H-benzo[d]imidazol-2-amine
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| Structure |
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| Formula |
C30H33FN4
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| Molecular Weight |
468.62
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| Canonical SMILES |
Fc1ccc(Cn2c(NC3CCN(CC4CCc5ccccc5C4)CC3)nc3ccccc23)cc1
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| InChI |
InChI=1S/C30H33FN4/c31-26-13-10-22(11-14-26)21-35-29-8-4-3-7-28(29)33-30(35)32-27-15-17-34(18-16-27)20-23-9-12-24-5-1-2-6-25(24)19-23/h1-8,10-11,13-14,23,27H,9,12,15-21H2,(H,32,33)
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| InChIKey |
WBKDIPKHMHKOSN-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