General Information of the Compound
| Compound ID |
CP0948917
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| Compound Name |
7-amino-3-benzyl-5-methylthiazolo[4,5-d]pyrimidin-2(3H)-one
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| Structure |
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| Formula |
C13H12N4OS
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| Molecular Weight |
272.333
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| Canonical SMILES |
Cc1nc(N)c2sc(=O)n(Cc3ccccc3)c2n1
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| InChI |
InChI=1S/C13H12N4OS/c1-8-15-11(14)10-12(16-8)17(13(18)19-10)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H2,14,15,16)
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| InChIKey |
XADWPKMPDYSQLS-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