General Information of the Compound
| Compound ID |
CP0334038
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| Compound Name |
6-[(E)-2-(3,4-dichlorophenyl)ethenyl]-1,3,5-trimethylpyrrolo[3,2-d]pyrimidine-2,4-dione
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| Structure |
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| Formula |
C17H15Cl2N3O2
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| Molecular Weight |
364.232
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| Canonical SMILES |
Cn1c(\C=C\c2ccc(Cl)c(Cl)c2)cc2n(C)c(=O)n(C)c(=O)c12
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| InChI |
InChI=1S/C17H15Cl2N3O2/c1-20-11(6-4-10-5-7-12(18)13(19)8-10)9-14-15(20)16(23)22(3)17(24)21(14)2/h4-9H,1-3H3/b6-4+
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| InChIKey |
PWIURQJUJAHQCK-GQCTYLIASA-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