COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK779825
Chemical Name: 2-[4-(2,5-dimethoxyphenyl)-2,5-dioxo-3,4,5,6,7,8-hexahydroquinolin-1(2H)-yl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile
Smiles: COc1ccc(c(c1)C1CC(=O)N(C2=C1C(=O)CCC2)c1sc2c(c1C#N)CCCCC2)OC

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Molecular Weight: 476.6
Empirical Formula: C27H28N2O4S

Physical State: Dry powder
Available Amount: 61 mg

Lipinsky:
logP: 4.323
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 107
Number of rings: 5

     

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