COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK779508
Chemical Name: 2-[4-(2-ethoxyphenyl)-2,5-dioxo-3,4,5,6,7,8-hexahydroquinolin-1(2H)-yl]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carbonitrile
Smiles: CCOc1ccccc1C1CC(=O)N(C2=C1C(=O)CCC2)c1sc2c(c1C#N)CCCCCC2

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Molecular Weight: 474.62
Empirical Formula: C28H30N2O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.453
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 98
Number of rings: 5

     

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