COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK687451
Chemical Name: 2-{2-amino-3-cyano-4-[4-(methylsulfanyl)phenyl]-5-oxo-5,6,7,8-tetrahydroquinolin-1(4H)-yl}-5,6-dihydro-4H-4,7-ethanothieno[2,3-b]pyridine-3-carbonitrile
Smiles: CSc1ccc(cc1)C1C(=C(N)N(C2=C1C(=O)CCC2)c1sc2c(c1C#N)C1CCN2CC1)C#N

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Molecular Weight: 499.66
Empirical Formula: C27H25N5OS2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.646
Rotatable bonds: 0
H-donors: 2
H-acceptors: 1
PSA: 150
Number of rings: 7

     

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