COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL170204
Chemical Name: methyl4-methyl-5-[(3-nitrophenyl)carbamoyl]-2-{[(4-nitrophenyl)carbonyl]amino}thiophene-3-carboxylate
Smiles: COC(=O)c1c(sc(c1C)C(=O)Nc1cccc(c1)[N+](=O)[O-])NC(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 484.45
Empirical Formula: C21H16N4O8S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 5.89
Rotatable bonds: 3
H-donors: 2
H-acceptors: 8
PSA: 204
Number of rings: 3

     

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