COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK551396
Chemical Name: [1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl][3-(morpholin-4-ylsulfonyl)phenyl]methanone
Smiles: CCOc1cc2c(cc1OCC)CCN(C2Cc1ccc(c(c1)OCC)OCC)C(=O)c1cccc(c1)S(=O)(=O)N1CCOCC1

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Molecular Weight: 652.81
Empirical Formula: C35H44N2O8S

Physical State: Dry powder
Available Amount: 320 mg

Lipinsky:
logP: 5.253
Rotatable bonds: 12
H-donors: 0
H-acceptors: 8
PSA: 112
Number of rings: 5

     

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