General Information of the Compound
| Compound ID |
CP0340056
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| Compound Name |
N-(3,4-difluorophenyl)-4-{2-phenylpyrazolo[1,5-a]pyridazin-3-yl}pyrimidin-2-amine
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| Structure |
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| Formula |
C22H14F2N6
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| Molecular Weight |
400.392
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| Canonical SMILES |
Fc1ccc(Nc2nccc(n2)-c2c(nn3ncccc23)-c2ccccc2)cc1F
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| InChI |
InChI=1S/C22H14F2N6/c23-16-9-8-15(13-17(16)24)27-22-25-12-10-18(28-22)20-19-7-4-11-26-30(19)29-21(20)14-5-2-1-3-6-14/h1-13H,(H,25,27,28)
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| InChIKey |
WYLUFGCIPSWIIG-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