COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK734255
Chemical Name: N-{2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl}-4-nitrobenzamide
Smiles: COc1cc(NC(=O)c2ccc(cc2)[N+](=O)[O-])c(cc1OC)Cc1nccc2c1cc(OC)c(c2)OC

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Molecular Weight: 503.51
Empirical Formula: C27H25N3O7

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.482
Rotatable bonds: 6
H-donors: 1
H-acceptors: 7
PSA: 124
Number of rings: 4

     

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