COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK104404
Chemical Name: 3-{[5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-nitrophenyl)pyrrolidine-2,5-dione
Smiles: COc1ccc(cc1)c1nnc([nH]1)SC1CC(=O)N(C1=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 425.42
Empirical Formula: C19H15N5O5S

Physical State: Dry powder
Available Amount: 428 mg

Lipinsky:
logP: 2.455
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 159
Number of rings: 4

     

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