COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK551818
Chemical Name: (5E)-1-(3-chloro-4-methylphenyl)-5-(4-methoxy-3-nitrobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(cc1[N+](=O)[O-])/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc(c(c1)Cl)C

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Molecular Weight: 415.79
Empirical Formula: C19H14ClN3O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.42
Rotatable bonds: 2
H-donors: 1
H-acceptors: 6
PSA: 121
Number of rings: 3

     

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