COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL112102
Chemical Name: 5-hydroxy-5-(4-nitrophenyl)-4-(prop-2-en-1-yl)-1,2,4-triazolidine-3-thione
Smiles: C=CCN1C(=S)NNC1(O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 280.31
Empirical Formula: C11H12N4O3S

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 1.454
Rotatable bonds: 3
H-donors: 3
H-acceptors: 3
PSA: 125
Number of rings: 2

     

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