COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL170552
Chemical Name: methyl4-[4-(butan-2-yl)phenyl]-2-{[(4-nitrophenyl)acetyl]amino}thiophene-3-carboxylate
Smiles: COC(=O)c1c(scc1c1ccc(cc1)C(CC)C)NC(=O)Cc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 452.53
Empirical Formula: C24H24N2O5S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 6.22
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 129
Number of rings: 3

     

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