General Information of the Compound
| Compound ID |
CP0497665
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| Compound Name |
5-cyclopropyl-3-[(2-ethyl-1,3-thiazol-4-yl)methyl]triazolo[4,5-d]pyrimidin-7-amine
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| Structure |
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| Formula |
C13H15N7S
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| Molecular Weight |
301.379
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| Canonical SMILES |
CCc1nc(Cn2nnc3c(N)nc(nc23)C2CC2)cs1
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| InChI |
InChI=1S/C13H15N7S/c1-2-9-15-8(6-21-9)5-20-13-10(18-19-20)11(14)16-12(17-13)7-3-4-7/h6-7H,2-5H2,1H3,(H2,14,16,17)
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| InChIKey |
XTSRPKXNHWNSED-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