General Information of the Compound
| Compound ID |
CP0430930
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| Compound Name |
5,6-dimethyl-2-(2-phenylethylsulfanyl)thieno[2,3-d]pyrimidin-4-amine
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| Structure |
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| Formula |
C16H17N3S2
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| Molecular Weight |
315.467
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| Canonical SMILES |
Cc1sc2nc(SCCc3ccccc3)nc(N)c2c1C
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| InChI |
InChI=1S/C16H17N3S2/c1-10-11(2)21-15-13(10)14(17)18-16(19-15)20-9-8-12-6-4-3-5-7-12/h3-7H,8-9H2,1-2H3,(H2,17,18,19)
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| InChIKey |
OKNYPWUDOXNGAB-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