COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK049107
Chemical Name: 2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-1-(2,2,4,6,7-pentamethylquinolin-1(2H)-yl)ethanone
Smiles: CCOc1ccc2c(c1)sc(n2)SCC(=O)N1c2cc(C)c(cc2C(=CC1(C)C)C)C

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Molecular Weight: 452.64
Empirical Formula: C25H28N2O2S2

Physical State: Dry powder
Available Amount: 536 mg

Lipinsky:
logP: 7.988
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 95
Number of rings: 4

     

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