General Information of the Compound
| Compound ID |
CP0913783
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| Compound Name |
4-(2,3-difluorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarbonitrile
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| Structure |
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| Formula |
C15H11F2N3
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| Molecular Weight |
271.27
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| Canonical SMILES |
CC1=C(C#N)C(c2cccc(F)c2F)C(C#N)=C(C)N1
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| InChI |
InChI=1S/C15H11F2N3/c1-8-11(6-18)14(12(7-19)9(2)20-8)10-4-3-5-13(16)15(10)17/h3-5,14,20H,1-2H3
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| InChIKey |
KXVDCPPOSPZQSC-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: PT06040, Voltage-dependent L-type calcium channel subunit alpha-1C
Protein ID: PT06039, Voltage-dependent L-type calcium channel subunit alpha-1D