COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK017900
Chemical Name: 2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-1-(2,2,4-trimethyl-4-phenyl-3,4-dihydroquinolin-1(2H)-yl)ethanone
Smiles: CCOc1ccc2c(c1)sc(n2)SCC(=O)N1c2ccccc2C(CC1(C)C)(C)c1ccccc1

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Molecular Weight: 502.7
Empirical Formula: C29H30N2O2S2

Physical State: Dry powder
Available Amount: 471 mg

Lipinsky:
logP: 8.633
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 95
Number of rings: 5

     

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