General Information of the Compound
| Compound ID |
CP0396364
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| Compound Name |
4-(2-hydroxyethyl)-1,5-diphenyl-N-[[2-(2,2,2-trifluoroethoxy)phenyl]methyl]pyrazole-3-carboxamide
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| Structure |
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| Formula |
C27H24F3N3O3
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| Molecular Weight |
495.501
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| Canonical SMILES |
OCCc1c(nn(c1-c1ccccc1)-c1ccccc1)C(=O)NCc1ccccc1OCC(F)(F)F
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| InChI |
InChI=1S/C27H24F3N3O3/c28-27(29,30)18-36-23-14-8-7-11-20(23)17-31-26(35)24-22(15-16-34)25(19-9-3-1-4-10-19)33(32-24)21-12-5-2-6-13-21/h1-14,34H,15-18H2,(H,31,35)
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| InChIKey |
ZOUUGAHNTNXEBN-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