COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK432423
Chemical Name: propan-2-yl2-{[(4-chloro-3-nitrophenyl)carbonyl]amino}-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate
Smiles: CCN(C(=O)c1sc(c(c1C)C(=O)OC(C)C)NC(=O)c1ccc(c(c1)[N+](=O)[O-])Cl)CC

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Molecular Weight: 481.96
Empirical Formula: C21H24ClN3O6S

Physical State: Dry powder
Available Amount: 640 mg

Lipinsky:
logP: 6.065
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 149
Number of rings: 2

     

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