COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK109261
Chemical Name: 2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-ylsulfanyl)-1-(2,2,4-trimethyl-4-phenyl-3,4-dihydroquinolin-1(2H)-yl)ethanone
Smiles: O=C(N1c2ccccc2C(CC1(C)C)(C)c1ccccc1)CSc1nnc2n1c1ccccc1s2

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Molecular Weight: 498.67
Empirical Formula: C28H26N4OS2

Physical State: Dry powder
Available Amount: 470 mg

Lipinsky:
logP: 8.195
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 104
Number of rings: 6

     

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