COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK601599
Chemical Name: (5Z)-5-(3-bromo-4-hydroxy-5-nitrobenzylidene)-6-hydroxy-3-(4-methoxyphenyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccc(cc1)N1C(=O)N=C(/C(=C/c2cc(Br)c(c(c2)[N+](=O)[O-])O)/C1=O)O

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Molecular Weight: 462.21
Empirical Formula: C18H12BrN3O7

Physical State: Dry powder
Available Amount: 93 mg

Lipinsky:
logP: 3.293
Rotatable bonds: 3
H-donors: 2
H-acceptors: 7
PSA: 145
Number of rings: 3

     

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