General Information of the Compound
| Compound ID |
CP0471802
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| Compound Name |
N-[4-[(3,4-difluorophenyl)methyl]-1,3-thiazol-2-yl]-2-(4-propan-2-ylphenyl)acetamide
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| Structure |
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| Formula |
C21H20F2N2OS
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| Molecular Weight |
386.467
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| Canonical SMILES |
CC(C)c1ccc(CC(=O)Nc2nc(Cc3ccc(F)c(F)c3)cs2)cc1
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| InChI |
InChI=1S/C21H20F2N2OS/c1-13(2)16-6-3-14(4-7-16)11-20(26)25-21-24-17(12-27-21)9-15-5-8-18(22)19(23)10-15/h3-8,10,12-13H,9,11H2,1-2H3,(H,24,25,26)
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| InChIKey |
BDLLJIUSXUTTMJ-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
Protein ID: PT03095, Voltage-dependent T-type calcium channel subunit alpha-1G
Protein ID: PT04557, Voltage-dependent T-type calcium channel subunit alpha-1H
Protein ID: PT02881, Voltage-dependent T-type calcium channel subunit alpha-1I