COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL020931
Chemical Name: methyl2-{[(2Z)-2-cyano-3-{5-[3-(trifluoromethyl)phenyl]furan-2-yl}prop-2-enoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: N#C/C(=C/c1ccc(o1)c1cccc(c1)C(F)(F)F)/C(=O)Nc1sc2c(c1C(=O)OC)CCCC2

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Molecular Weight: 500.5
Empirical Formula: C25H19F3N2O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.862
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 120
Number of rings: 4

     

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