General Information of the Compound
| Compound ID |
CP0552531
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| Compound Name |
(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(4-methoxyphenyl)methanol
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| Structure |
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| Formula |
C16H17N3O2S
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| Molecular Weight |
315.398
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| Canonical SMILES |
COc1ccc(cc1)C(O)c1sc2nnc(C)c(C)c2c1N
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| InChI |
InChI=1S/C16H17N3O2S/c1-8-9(2)18-19-16-12(8)13(17)15(22-16)14(20)10-4-6-11(21-3)7-5-10/h4-7,14,20H,17H2,1-3H3
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| InChIKey |
UTSTZNOQLUFBQE-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