COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK307975
Chemical Name: 2-({5-[2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)ethyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-methoxy-5-nitrophenyl)acetamide
Smiles: COc1cc(NC(=O)CSc2nnc(n2C)CCn2nc(c(c2C)[N+](=O)[O-])C)cc(c1)[N+](=O)[O-]

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Molecular Weight: 490.5
Empirical Formula: C19H22N8O6S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.993
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 203
Number of rings: 3

     

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