COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK358822
Chemical Name: methyl4-{[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4-(methylsulfanyl)butanoyl]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)C(N1C(=O)c2c(C1=O)cccc2)CCSC

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Molecular Weight: 412.47
Empirical Formula: C21H20N2O5S

Physical State: Dry powder
Available Amount: 227 mg

Lipinsky:
logP: 4.668
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 118
Number of rings: 3

     

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