General Information of the Compound
| Compound ID |
CP0513671
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| Compound Name |
2-fluoro-N-[1-[(6-fluoronaphthalen-2-yl)methyl]piperidin-4-yl]benzamide
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| Structure |
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| Formula |
C23H22F2N2O
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| Molecular Weight |
380.438
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| Canonical SMILES |
Fc1ccc2cc(CN3CCC(CC3)NC(=O)c3ccccc3F)ccc2c1
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| InChI |
InChI=1S/C23H22F2N2O/c24-19-8-7-17-13-16(5-6-18(17)14-19)15-27-11-9-20(10-12-27)26-23(28)21-3-1-2-4-22(21)25/h1-8,13-14,20H,9-12,15H2,(H,26,28)
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| InChIKey |
PGBWNUGAHUIGEF-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