General Information of the Compound
| Compound ID |
CP0491268
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| Compound Name |
2-(2-Furyl)-5-methylthio-7-n-pentylcarbonylamino-[1,2,4]-triazolo[1,5-a]-[1,3,5]triazine
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| Structure |
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| Formula |
C15H18N6O2S
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| Molecular Weight |
346.416
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| Canonical SMILES |
CCCCCC(=O)Nc1nc(SC)nc2nc(nn12)-c1ccco1
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| InChI |
InChI=1S/C15H18N6O2S/c1-3-4-5-8-11(22)16-13-18-15(24-2)19-14-17-12(20-21(13)14)10-7-6-9-23-10/h6-7,9H,3-5,8H2,1-2H3,(H,16,17,18,19,20,22)
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| InChIKey |
HWWAJIDHSOUPND-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