COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL020976
Chemical Name: ethyl2-{[(2E)-3-{5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-yl}-2-cyanoprop-2-enoyl]amino}-4,5-dimethylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)/C(=C/c2ccc(o2)c2cc(ccc2Cl)C(F)(F)F)/C#N)sc(c1C)C

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Molecular Weight: 522.93
Empirical Formula: C24H18ClF3N2O4S

Physical State: Dry powder
Available Amount: 258 mg

Lipinsky:
logP: 9.179
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 120
Number of rings: 3

     

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