General Information of the Compound
| Compound ID |
CP0566451
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| Compound Name |
(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(2,4-difluorophenyl)methanol
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| Structure |
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| Formula |
C15H13F2N3OS
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| Molecular Weight |
321.352
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| Canonical SMILES |
Cc1nnc2sc(C(O)c3ccc(F)cc3F)c(N)c2c1C
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| InChI |
InChI=1S/C15H13F2N3OS/c1-6-7(2)19-20-15-11(6)12(18)14(22-15)13(21)9-4-3-8(16)5-10(9)17/h3-5,13,21H,18H2,1-2H3
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| InChIKey |
IONUCYUTLQPLSH-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: PT01156, Muscarinic acetylcholine receptor M4
Protein ID: PT01736, Muscarinic acetylcholine receptor M4