COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK008599
Chemical Name: N-[1-(3,4-dimethoxyphenyl)-6,7-dimethoxy-3-oxo-3,4-dihydroisoquinolin-2(1H)-yl]-4-nitrobenzamide
Smiles: COc1cc(ccc1OC)C1N(NC(=O)c2ccc(cc2)[N+](=O)[O-])C(=O)Cc2c1cc(OC)c(c2)OC

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Molecular Weight: 507.5
Empirical Formula: C26H25N3O8

Physical State: Dry powder
Available Amount: 22 mg

Lipinsky:
logP: 2.382
Rotatable bonds: 6
H-donors: 1
H-acceptors: 8
PSA: 132
Number of rings: 4

     

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