COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK780122
Chemical Name: 2-[2,5-dioxo-4-(3,4,5-trimethoxyphenyl)-3,4,5,6,7,8-hexahydroquinolin-1(2H)-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Smiles: COc1cc(cc(c1OC)OC)C1CC(=O)N(C2=C1C(=O)CCC2)c1sc2c(c1C#N)CCCC2

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Molecular Weight: 492.6
Empirical Formula: C27H28N2O5S

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 3.317
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 117
Number of rings: 5

     

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