General Information of the Compound
| Compound ID |
CP0390931
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| Compound Name |
(2-(cyclohexylmethylamino)thieno[3,2-d]pyrimidin-4-yl)(5-methylthiophen-2-yl)methanone
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| Structure |
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| Formula |
C19H21N3OS2
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| Molecular Weight |
371.531
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| Canonical SMILES |
Cc1ccc(s1)C(=O)c1nc(NCC2CCCCC2)nc2ccsc12
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| InChI |
InChI=1S/C19H21N3OS2/c1-12-7-8-15(25-12)17(23)16-18-14(9-10-24-18)21-19(22-16)20-11-13-5-3-2-4-6-13/h7-10,13H,2-6,11H2,1H3,(H,20,21,22)
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| InChIKey |
ZUIYNLUWOGEEJV-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: PT00862, Adenosine receptor A2a
Protein ID: PT01278, Adenosine receptor A2b