COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK578356
Chemical Name: (2Z)-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1(2H)-ylidene)-1-[2-(4-ethylphenyl)-4-methyl-1,3-thiazol-5-yl]ethanone
Smiles: COc1cc2/C(=C/C(=O)c3sc(nc3C)c3ccc(cc3)CC)/NCCc2cc1OC

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Molecular Weight: 434.56
Empirical Formula: C25H26N2O3S

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 5.848
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 88
Number of rings: 4

     

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