General Information of the Compound
| Compound ID |
CP0404914
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| Compound Name |
(rac)-N-{1-[(6-Fluoro-2-naphthyl)methyl]piperidin-3-yl}-biphenyl-2-carboxamide
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| Structure |
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| Formula |
C29H27FN2O
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| Molecular Weight |
438.546
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| Canonical SMILES |
Fc1ccc2cc(CN3CCCC(C3)NC(=O)c3ccccc3-c3ccccc3)ccc2c1
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| InChI |
InChI=1S/C29H27FN2O/c30-25-15-14-23-17-21(12-13-24(23)18-25)19-32-16-6-9-26(20-32)31-29(33)28-11-5-4-10-27(28)22-7-2-1-3-8-22/h1-5,7-8,10-15,17-18,26H,6,9,16,19-20H2,(H,31,33)
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| InChIKey |
GDDUTDROJXVVIG-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