General Information of the Compound
| Compound ID |
CP0562827
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| Compound Name |
7-ethyl-2-[2-(pyridin-2-ylamino)ethylamino]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
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| Structure |
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| Formula |
C14H16N6OS
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| Molecular Weight |
316.39
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| Canonical SMILES |
CCc1cc(=O)n2nc(NCCNc3ccccn3)sc2n1
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| InChI |
InChI=1S/C14H16N6OS/c1-2-10-9-12(21)20-14(18-10)22-13(19-20)17-8-7-16-11-5-3-4-6-15-11/h3-6,9H,2,7-8H2,1H3,(H,15,16)(H,17,19)
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| InChIKey |
QONVAYXHZABMBX-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