COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK252740
Chemical Name: 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4-(methylsulfanyl)-N-(4-nitrophenyl)butanamide
Smiles: CSCCC(N1C(=O)c2c(C1=O)cccc2)C(=O)Nc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 399.43
Empirical Formula: C19H17N3O5S

Physical State: Dry powder
Available Amount: 156 mg

Lipinsky:
logP: 4.538
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 137
Number of rings: 3

     

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