COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK093786
Chemical Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-1-(2,2,4-trimethyl-4-phenyl-3,4-dihydroquinolin-1(2H)-yl)ethanone
Smiles: O=C(N1c2ccccc2C(CC1(C)C)(C)c1ccccc1)CSc1nc2c(s1)cccc2

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Molecular Weight: 458.65
Empirical Formula: C27H26N2OS2

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 8.186
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 86
Number of rings: 5

     

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