General Information of the Compound
| Compound ID |
CP0467318
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| Compound Name |
N-[4-[2-[di(propan-2-yl)amino]ethoxy]-3-methoxyphenyl]-4-[4-(trifluoromethyl)phenyl]benzamide
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| Structure |
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| Formula |
C29H33F3N2O3
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| Molecular Weight |
514.588
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| Canonical SMILES |
COc1cc(NC(=O)c2ccc(cc2)-c2ccc(cc2)C(F)(F)F)ccc1OCCN(C(C)C)C(C)C
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| InChI |
InChI=1S/C29H33F3N2O3/c1-19(2)34(20(3)4)16-17-37-26-15-14-25(18-27(26)36-5)33-28(35)23-8-6-21(7-9-23)22-10-12-24(13-11-22)29(30,31)32/h6-15,18-20H,16-17H2,1-5H3,(H,33,35)
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| InChIKey |
ZPMYQJFFJVPFJF-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