COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL246929
Chemical Name: 1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-3-([1,2,4]triazolo[4,3-b]pyridazin-6-ylsulfanyl)propan-1-one
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)CCSc1ccc2n(n1)cnn2

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Molecular Weight: 399.47
Empirical Formula: C19H21N5O3S

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 1.548
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 107
Number of rings: 4

     

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