General Information of the Compound
| Compound ID |
CP0272482
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| Compound Name |
N-[2-[4-[(4-acetamidopiperidin-1-yl)methyl]phenyl]ethyl]-4-(4-fluorophenyl)-N-methylbenzamide
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| Structure |
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| Formula |
C30H34FN3O2
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| Molecular Weight |
487.619
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| Canonical SMILES |
CN(CCc1ccc(CN2CCC(CC2)NC(C)=O)cc1)C(=O)c1ccc(cc1)-c1ccc(F)cc1
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| InChI |
InChI=1S/C30H34FN3O2/c1-22(35)32-29-16-19-34(20-17-29)21-24-5-3-23(4-6-24)15-18-33(2)30(36)27-9-7-25(8-10-27)26-11-13-28(31)14-12-26/h3-14,29H,15-21H2,1-2H3,(H,32,35)
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| InChIKey |
MGORRVRDTUOGIX-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