COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK565787
Chemical Name: (5Z)-5-(4,5-dimethoxy-2-nitrobenzylidene)-1-(3-ethoxyphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CCOc1cccc(c1)N1C(=NC(=O)/C(=C/c2cc(OC)c(cc2[N+](=O)[O-])OC)/C1=O)S

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Molecular Weight: 457.46
Empirical Formula: C21H19N3O7S

Physical State: Dry powder
Available Amount: 105 mg

Lipinsky:
logP: 3.995
Rotatable bonds: 6
H-donors: 0
H-acceptors: 7
PSA: 162
Number of rings: 3

     

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