COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK195614
Chemical Name: (5Z)-1-(3-bromophenyl)-5-(5-methoxy-2-nitrobenzylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: COc1ccc(c(c1)/C=C\1/C(=O)NC(=S)N(C1=O)c1cccc(c1)Br)[N+](=O)[O-]

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Molecular Weight: 462.28
Empirical Formula: C18H12BrN3O5S

Physical State: Dry powder
Available Amount: 34 mg

Lipinsky:
logP: 3.719
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 136
Number of rings: 3

     

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