COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK340911
Chemical Name: dimethyl5-{[4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanoyl]amino}-3-methylthiophene-2,4-dicarboxylate
Smiles: COC(=O)c1c(NC(=O)CCCn2nc(c(c2C)[N+](=O)[O-])C)sc(c1C)C(=O)OC

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Molecular Weight: 438.46
Empirical Formula: C18H22N4O7S

Available Amount: 0 mg

Lipinsky:
logP: 4.339
Rotatable bonds: 8
H-donors: 1
H-acceptors: 7
PSA: 173
Number of rings: 2

     

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