COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK585005
Chemical Name: (2E)-3-(3-chloro-4-ethoxy-5-methoxyphenyl)-1-(6,7-dimethoxy-1-methylidene-3,4-dihydroisoquinolin-2(1H)-yl)prop-2-en-1-one
Smiles: CCOc1c(Cl)cc(cc1OC)/C=C/C(=O)N1CCc2c(C1=C)cc(c(c2)OC)OC

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Molecular Weight: 443.93
Empirical Formula: C24H26ClNO5

Physical State: Dry powder
Available Amount: 201 mg

Lipinsky:
logP: 5.956
Rotatable bonds: 7
H-donors: 0
H-acceptors: 5
PSA: 57
Number of rings: 3

     

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