COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK392388
Chemical Name: ethyl2-({(2E)-2-cyano-3-[5-(2-nitrophenyl)furan-2-yl]prop-2-enoyl}amino)-4,5-dimethylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)/C(=C/c2ccc(o2)c2ccccc2[N+](=O)[O-])/C#N)sc(c1C)C

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Molecular Weight: 465.49
Empirical Formula: C23H19N3O6S

Physical State: Dry powder
Available Amount: 452 mg

Lipinsky:
logP: 7.203
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 166
Number of rings: 3

     

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