General Information of the Compound
| Compound ID |
CP0412188
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| Compound Name |
N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]-2-[[4-(trifluoromethoxy)phenyl]methyl]-1,3-oxazole-4-carboxamide
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| Structure |
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| Formula |
C22H21F3N4O3
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| Molecular Weight |
446.429
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| Canonical SMILES |
FC(F)(F)Oc1ccc(Cc2nc(co2)C(=O)NCc2ccc(nc2)N2CCCC2)cc1
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| InChI |
InChI=1S/C22H21F3N4O3/c23-22(24,25)32-17-6-3-15(4-7-17)11-20-28-18(14-31-20)21(30)27-13-16-5-8-19(26-12-16)29-9-1-2-10-29/h3-8,12,14H,1-2,9-11,13H2,(H,27,30)
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| InChIKey |
GGLRFXACWCOWSX-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