COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK451477
Chemical Name: 2-methyl4-propan-2-yl3-methyl-5-{[(3-nitrophenyl)carbonyl]amino}thiophene-2,4-dicarboxylate
Smiles: COC(=O)c1sc(c(c1C)C(=O)OC(C)C)NC(=O)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 406.42
Empirical Formula: C18H18N2O7S

Physical State: Dry powder
Available Amount: 345 mg

Lipinsky:
logP: 5.808
Rotatable bonds: 6
H-donors: 1
H-acceptors: 7
PSA: 155
Number of rings: 2

     

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