General Information of the Compound
| Compound ID |
CP0500372
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| Compound Name |
2-(2,4-Dichloro-phenyl)-5-dipropylamino-3-ethyl-6-methyl-3H-pyrimidin-4-one
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| Structure |
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| Formula |
C19H25Cl2N3O
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| Molecular Weight |
382.335
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| Canonical SMILES |
CCCN(CCC)c1c(C)nc(-c2ccc(Cl)cc2Cl)n(CC)c1=O
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| InChI |
InChI=1S/C19H25Cl2N3O/c1-5-10-23(11-6-2)17-13(4)22-18(24(7-3)19(17)25)15-9-8-14(20)12-16(15)21/h8-9,12H,5-7,10-11H2,1-4H3
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| InChIKey |
CZZWROMXVJEUPV-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