COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL565906
Chemical Name: 2-{2-[(3S)-3-carbamoyl-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl]-2-oxoethyl}benzoicacid
Smiles: COc1cc2C[C@@H](C(=O)N)N(Cc2cc1OC)C(=O)Cc1ccccc1C(=O)O

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Molecular Weight: 398.42
Empirical Formula: C21H22N2O6

Physical State: Liquid
Available Amount: 300 mg

Lipinsky:
logP: 1.547
Rotatable bonds: 6
H-donors: 3
H-acceptors: 6
PSA: 119
Number of rings: 3

     

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