COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK492969
Chemical Name: diethyl5-{[(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)acetyl]amino}-3-methylthiophene-2,4-dicarboxylate
Smiles: CCOC(=O)c1c(NC(=O)Cn2nc(c(c2C)Br)[N+](=O)[O-])sc(c1C)C(=O)OCC

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Molecular Weight: 503.33
Empirical Formula: C17H19BrN4O7S

Physical State: Dry powder
Available Amount: 185 mg

Lipinsky:
logP: 5.106
Rotatable bonds: 8
H-donors: 1
H-acceptors: 7
PSA: 173
Number of rings: 2

     

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