COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK591583
Chemical Name: 1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-[4-(4-nitrophenyl)piperazin-1-yl]ethanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)CN1CCN(CC1)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 440.5
Empirical Formula: C23H28N4O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.797
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 91
Number of rings: 4

     

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