COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK452548
Chemical Name: methyl5-methyl-2-{[(3-methyl-4-nitrophenyl)carbonyl]amino}-4-(4-methylphenyl)thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)c2ccc(c(c2)C)[N+](=O)[O-])sc(c1c1ccc(cc1)C)C

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Molecular Weight: 424.48
Empirical Formula: C22H20N2O5S

Physical State: Dry powder
Available Amount: 2198 mg

Lipinsky:
logP: 6.929
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 129
Number of rings: 3

     

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