General Information of the Compound
| Compound ID |
CP0454043
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| Compound Name |
N-[1-[(6-fluoronaphthalen-2-yl)methyl]-4-methylpiperidin-4-yl]-2-phenylbenzamide
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| Structure |
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| Formula |
C30H29FN2O
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| Molecular Weight |
452.573
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| Canonical SMILES |
CC1(CCN(Cc2ccc3cc(F)ccc3c2)CC1)NC(=O)c1ccccc1-c1ccccc1
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| InChI |
InChI=1S/C30H29FN2O/c1-30(32-29(34)28-10-6-5-9-27(28)23-7-3-2-4-8-23)15-17-33(18-16-30)21-22-11-12-25-20-26(31)14-13-24(25)19-22/h2-14,19-20H,15-18,21H2,1H3,(H,32,34)
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| InChIKey |
GWYXBOAOMUWHGP-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