COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK193005
Chemical Name: (5E)-1-(3-bromophenyl)-5-(2,4-dimethoxy-5-nitrobenzylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: COc1cc(OC)c(cc1/C=C/1\C(=O)NC(=S)N(C1=O)c1cccc(c1)Br)[N+](=O)[O-]

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Molecular Weight: 492.31
Empirical Formula: C19H14BrN3O6S

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 3.792
Rotatable bonds: 3
H-donors: 1
H-acceptors: 6
PSA: 145
Number of rings: 3

     

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