COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK811672
Chemical Name: methyl4-{(E)-2-[5-(acetylamino)-4-(4-methylphenyl)-1,3-thiazol-2-yl]-2-cyanoethenyl}benzoate
Smiles: N#C/C(=C\c1ccc(cc1)C(=O)OC)/c1sc(c(n1)c1ccc(cc1)C)NC(=O)C

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Molecular Weight: 417.49
Empirical Formula: C23H19N3O3S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 3.934
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 120
Number of rings: 3

     

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