COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK435629
Chemical Name: methyl4-(4-bromophenyl)-2-{[(2-chloro-5-nitrophenyl)carbonyl]amino}thiophene-3-carboxylate
Smiles: COC(=O)c1c(scc1c1ccc(cc1)Br)NC(=O)c1cc(ccc1Cl)[N+](=O)[O-]

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Molecular Weight: 495.74
Empirical Formula: C19H12BrClN2O5S

Physical State: Dry powder
Available Amount: 785 mg

Lipinsky:
logP: 6.532
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 129
Number of rings: 3

     

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