COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK255575
Chemical Name: 3-{[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4-(methylsulfanyl)butanoyl]amino}benzoicacid
Smiles: CSCCC(N1C(=O)c2c(C1=O)cccc2)C(=O)Nc1cccc(c1)C(=O)O

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Molecular Weight: 398.44
Empirical Formula: C20H18N2O5S

Physical State: Dry powder
Available Amount: 44 mg

Lipinsky:
logP: 4.197
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 129
Number of rings: 3

     

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