COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK758501
Chemical Name: ethyl2-[2-amino-3-cyano-4-(4-ethoxyphenyl)-5-oxo-5,6,7,8-tetrahydroquinolin-1(4H)-yl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: CCOc1ccc(cc1)C1C(=C(N)N(C2=C1C(=O)CCC2)c1sc2c(c1C(=O)OCC)CCCCC2)C#N

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Molecular Weight: 531.68
Empirical Formula: C30H33N3O4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.37
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 133
Number of rings: 5

     

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