General Information of the Compound
| Compound ID |
CP0013965
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| Compound Name |
10-[(3,5-difluoropyridin-4-yl)methyl]-10-(pyridazin-4-ylmethyl)anthracen-9-one
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| Structure |
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| Formula |
C25H17F2N3O
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| Molecular Weight |
413.427
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| Canonical SMILES |
Fc1cncc(F)c1CC1(Cc2ccnnc2)c2ccccc2C(=O)c2ccccc12
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| InChI |
InChI=1S/C25H17F2N3O/c26-22-14-28-15-23(27)19(22)12-25(11-16-9-10-29-30-13-16)20-7-3-1-5-17(20)24(31)18-6-2-4-8-21(18)25/h1-10,13-15H,11-12H2
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| InChIKey |
TULGAOOGTOFKPH-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: PT00897, Potassium voltage-gated channel subfamily H member 2
Protein ID: PT03912, Potassium voltage-gated channel subfamily KQT member 2