General Information of the Compound
| Compound ID |
CP0248569
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| Compound Name |
6-[(E)-2-(4-chlorophenyl)ethenyl]-1,3-diethyl-5-methylpyrrolo[3,2-d]pyrimidine-2,4-dione
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| Structure |
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| Formula |
C19H20ClN3O2
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| Molecular Weight |
357.841
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| Canonical SMILES |
CCn1c2cc(\C=C\c3ccc(Cl)cc3)n(C)c2c(=O)n(CC)c1=O
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| InChI |
InChI=1S/C19H20ClN3O2/c1-4-22-16-12-15(11-8-13-6-9-14(20)10-7-13)21(3)17(16)18(24)23(5-2)19(22)25/h6-12H,4-5H2,1-3H3/b11-8+
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| InChIKey |
QAQCQFXJKYDZKJ-DHZHZOJOSA-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