General Information of the Compound
| Compound ID |
CP0482176
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| Compound Name |
2-[(3,4-difluorophenyl)methyl]-N-[(1-methylindazol-5-yl)methyl]triazole-4-carboxamide
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| Structure |
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| Formula |
C19H16F2N6O
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| Molecular Weight |
382.374
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| Canonical SMILES |
Cn1ncc2cc(CNC(=O)c3cnn(Cc4ccc(F)c(F)c4)n3)ccc12
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| InChI |
InChI=1S/C19H16F2N6O/c1-26-18-5-3-12(6-14(18)9-23-26)8-22-19(28)17-10-24-27(25-17)11-13-2-4-15(20)16(21)7-13/h2-7,9-10H,8,11H2,1H3,(H,22,28)
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| InChIKey |
FQDAYMWSKCIFFZ-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