General Information of the Compound
| Compound ID |
CP0823429
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| Compound Name |
2-(4-(1-hydroxy-3-azabicyclo[3.1.0]hexane-3-carbonyl)-5-methyl-1H-pyrazol-1-yl)thieno[2,3-d]pyrimidin-4(3H)-one
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| Structure |
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| Formula |
C16H15N5O3S
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| Molecular Weight |
357.395
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| Canonical SMILES |
Cc1c(C(=O)N2CC3CC3(O)C2)cnn1-c1nc2sccc2c(=O)[nH]1
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| InChI |
InChI=1S/C16H15N5O3S/c1-8-11(14(23)20-6-9-4-16(9,24)7-20)5-17-21(8)15-18-12(22)10-2-3-25-13(10)19-15/h2-3,5,9,24H,4,6-7H2,1H3,(H,18,19,22)
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| InChIKey |
MLKKPBATVGXXDX-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