COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL112903
Chemical Name: (2E)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-3-(3-ethoxy-4-hydroxyphenyl)prop-2-enenitrile
Smiles: CCOc1cc(ccc1O)/C=C(/c1scc(n1)c1ccc(cc1)Cl)\C#N

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Molecular Weight: 382.87
Empirical Formula: C20H15ClN2O2S

Physical State: Dry powder
Available Amount: 66 mg

Lipinsky:
logP: 5.782
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 94
Number of rings: 3

     

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