General Information of the Compound
| Compound ID |
CP0901910
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| Compound Name |
6-morpholin-4-ylmethyl-2-thiophen-2-yl-thieno-[2,3-d]pyrimidin-4-ylamine
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| Structure |
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| Formula |
C15H16N4OS2
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| Molecular Weight |
332.454
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| Canonical SMILES |
Nc1nc(-c2cccs2)nc2sc(CN3CCOCC3)cc12
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| InChI |
InChI=1S/C15H16N4OS2/c16-13-11-8-10(9-19-3-5-20-6-4-19)22-15(11)18-14(17-13)12-2-1-7-21-12/h1-2,7-8H,3-6,9H2,(H2,16,17,18)
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| InChIKey |
DOMXNZRQNDUQIV-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: PT00840, Adenosine receptor A1
Protein ID: PT00862, Adenosine receptor A2a