COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK444876
Chemical Name: ethyl2-{[(2-chloro-5-nitrophenyl)carbonyl]amino}-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2cc(ccc2Cl)[N+](=O)[O-])sc(c1C)C(=O)N(C)C

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Molecular Weight: 439.88
Empirical Formula: C18H18ClN3O6S

Physical State: Dry powder
Available Amount: 390 mg

Lipinsky:
logP: 4.644
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 149
Number of rings: 2

     

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