General Information of the Compound
| Compound ID |
CP0046252
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| Compound Name |
4-(4-fluorophenyl)-1-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-3,6-dihydro-2H-pyridine
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| Structure |
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| Formula |
C26H26FNO2
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| Molecular Weight |
403.497
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| Canonical SMILES |
COc1ccc(CN2CCC(=CC2)c2ccc(F)cc2)cc1OCc1ccccc1
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| InChI |
InChI=1S/C26H26FNO2/c1-29-25-12-7-21(17-26(25)30-19-20-5-3-2-4-6-20)18-28-15-13-23(14-16-28)22-8-10-24(27)11-9-22/h2-13,17H,14-16,18-19H2,1H3
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| InChIKey |
VLRBSIRKSQHOLQ-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