General Information of the Compound
| Compound ID |
CP0367093
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| Compound Name |
6-[2-(3,5-difluorophenyl)ethyl]-1,2-dihydropyridazine-3,4-dione
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| Structure |
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| Formula |
C12H10F2N2O2
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| Molecular Weight |
252.22
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| Canonical SMILES |
Oc1cc(CCc2cc(F)cc(F)c2)n[nH]c1=O
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| InChI |
InChI=1S/C12H10F2N2O2/c13-8-3-7(4-9(14)5-8)1-2-10-6-11(17)12(18)16-15-10/h3-6H,1-2H2,(H,15,17)(H,16,18)
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| InChIKey |
BLEWCUQOJLGDAH-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