COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK301915
Chemical Name: N-{3-[(2,3-dihydroxypropyl)sulfanyl]-5-nitrophenyl}-1,3-benzodioxole-5-carboxamide
Smiles: OCC(CSc1cc(NC(=O)c2ccc3c(c2)OCO3)cc(c1)[N+](=O)[O-])O

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Molecular Weight: 392.39
Empirical Formula: C17H16N2O7S

Physical State: Dry powder
Available Amount: 54 mg

Lipinsky:
logP: 1.812
Rotatable bonds: 7
H-donors: 3
H-acceptors: 7
PSA: 159
Number of rings: 3

     

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