COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL512696
Chemical Name: N-[1-(3,4-dimethoxybenzyl)-6,7-dimethoxyisoquinolin-3-yl]-2-(3,4-dimethoxyphenyl)ethanimidamide
Smiles: COc1cc2cc(NC(=N)Cc3ccc(c(c3)OC)OC)nc(c2cc1OC)Cc1ccc(c(c1)OC)OC

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Saltdata: 2 HCl
Molecular Weight: 531.61
Empirical Formula: C30H33N3O6

Physical State: Dry powder
Available Amount: 58 mg

Lipinsky:
logP: 3.967
Rotatable bonds: 10
H-donors: 2
H-acceptors: 6
PSA: 104
Number of rings: 4

     

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