COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK597183
Chemical Name: (2Z)-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1(2H)-ylidene)-1-[2-(thiophen-2-yl)quinolin-4-yl]ethanone
Smiles: COc1cc2CCN/C(=C\C(=O)c3cc(nc4c3cccc4)c3cccs3)/c2cc1OC

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Molecular Weight: 442.54
Empirical Formula: C26H22N2O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.093
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 88
Number of rings: 5

     

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