COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK683689
Chemical Name: ethyl2-[({2-methyl-4-[4-(methylsulfanyl)phenyl]-5-oxo-1,4,5,6,7,8-hexahydroquinolin-3-yl}carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)C2=C(C)NC3=C(C2c2ccc(cc2)SC)C(=O)CCC3)sc2c1CCCC2

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Molecular Weight: 536.72
Empirical Formula: C29H32N2O4S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 7.313
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 138
Number of rings: 5

     

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