General Information of the Compound
| Compound ID |
CP0526595
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| Compound Name |
1-(4-(3-(4-benzylpiperidin-1-yl)propoxy)phenyl)-5-fluoro-2-(pyridin-2-yl)-1H-benzo[d]imidazole
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| Structure |
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| Formula |
C33H33FN4O
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| Molecular Weight |
520.652
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| Canonical SMILES |
Fc1ccc2n(c(nc2c1)-c1ccccn1)-c1ccc(OCCCN2CCC(Cc3ccccc3)CC2)cc1
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| InChI |
InChI=1S/C33H33FN4O/c34-27-10-15-32-31(24-27)36-33(30-9-4-5-18-35-30)38(32)28-11-13-29(14-12-28)39-22-6-19-37-20-16-26(17-21-37)23-25-7-2-1-3-8-25/h1-5,7-15,18,24,26H,6,16-17,19-23H2
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| InChIKey |
LCBCWRXFGAQTSR-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