COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK757818
Chemical Name: ethyl2-[2-amino-4-(1,3-benzodioxol-5-yl)-3-cyano-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinolin-1(4H)-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(sc2c1CCCC2)N1C(=C(C#N)C(C2=C1CC(C)(C)CC2=O)c1ccc2c(c1)OCO2)N

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Molecular Weight: 545.66
Empirical Formula: C30H31N3O5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.253
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 143
Number of rings: 6

     

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