General Information of the Compound
| Compound ID |
CP0535905
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| Compound Name |
N-[[4-[4-fluoro-3-(trifluoromethyl)phenyl]phenyl]methyl]-2-[4-(1,8-naphthyridin-2-yl)phenyl]acetamide
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| Structure |
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| Formula |
C30H21F4N3O
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| Molecular Weight |
515.51
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| Canonical SMILES |
Fc1ccc(cc1C(F)(F)F)-c1ccc(CNC(=O)Cc2ccc(cc2)-c2ccc3cccnc3n2)cc1
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| InChI |
InChI=1S/C30H21F4N3O/c31-26-13-11-24(17-25(26)30(32,33)34)21-7-5-20(6-8-21)18-36-28(38)16-19-3-9-22(10-4-19)27-14-12-23-2-1-15-35-29(23)37-27/h1-15,17H,16,18H2,(H,36,38)
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| InChIKey |
HHRYPESKSYSREM-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