COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK071790
Chemical Name: 2-[4-(methylsulfanyl)-1-oxo-1-(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)butan-2-yl]-1H-isoindole-1,3(2H)-dione
Smiles: CSCCC(N1C(=O)c2c(C1=O)cccc2)C(=O)N1CC2(CC1CC(C2)(C)C)C

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Molecular Weight: 414.57
Empirical Formula: C23H30N2O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.538
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 82
Number of rings: 4

     

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