COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL514997
Chemical Name: 6-[(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)acetyl]-2H-1,4-benzoxazin-3(4H)-one
Smiles: COc1cc2CCN(Cc2cc1OC)CC(=O)c1ccc2c(c1)NC(=O)CO2

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Molecular Weight: 382.42
Empirical Formula: C21H22N2O5

Physical State: Dry powder
Available Amount: 307 mg

Lipinsky:
logP: 2.415
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 77
Number of rings: 4

     

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