General Information of the Compound
| Compound ID |
CP0220103
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| Compound Name |
6-[4-(4-chlorophenyl)triazol-1-yl]-1,3,5-trimethylpyrrolo[3,2-d]pyrimidine-2,4-dione
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| Structure |
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| Formula |
C17H15ClN6O2
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| Molecular Weight |
370.8
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| Canonical SMILES |
Cn1c(cc2n(C)c(=O)n(C)c(=O)c12)-n1cc(nn1)-c1ccc(Cl)cc1
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| InChI |
InChI=1S/C17H15ClN6O2/c1-21-13-8-14(22(2)15(13)16(25)23(3)17(21)26)24-9-12(19-20-24)10-4-6-11(18)7-5-10/h4-9H,1-3H3
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| InChIKey |
RWDJCJAJXOOBDM-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