COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK551478
Chemical Name: 3-{[1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl]carbonyl}-N,N-diethylbenzenesulfonamide
Smiles: CCOc1cc2c(cc1OCC)CCN(C2Cc1ccc(c(c1)OCC)OCC)C(=O)c1cccc(c1)S(=O)(=O)N(CC)CC

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Molecular Weight: 638.83
Empirical Formula: C35H46N2O7S

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 6.6
Rotatable bonds: 14
H-donors: 0
H-acceptors: 7
PSA: 102
Number of rings: 4

     

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