General Information of the Compound
| Compound ID |
CP0485861
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| Compound Name |
2-[4-(2-Methoxy-phenyl)-piperidin-1-ylmethyl]-1H-benzoimidazole
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| Structure |
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| Formula |
C20H23N3O
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| Molecular Weight |
321.424
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| Canonical SMILES |
COc1ccccc1C1CCN(Cc2nc3ccccc3[nH]2)CC1
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| InChI |
InChI=1S/C20H23N3O/c1-24-19-9-5-2-6-16(19)15-10-12-23(13-11-15)14-20-21-17-7-3-4-8-18(17)22-20/h2-9,15H,10-14H2,1H3,(H,21,22)
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| InChIKey |
QKKFQHBDHBMWGM-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