COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK622696
Chemical Name: N-(1,1-dioxidotetrahydrothiophen-3-yl)-N~3~-(5-nitropyridin-2-yl)-beta-alaninamide
Smiles: O=C(NC1CCS(=O)(=O)C1)CCNc1ccc(cn1)[N+](=O)[O-]

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Molecular Weight: 328.35
Empirical Formula: C12H16N4O5S

Physical State: Dry powder
Available Amount: 307 mg

Lipinsky:
logP: -0.756
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 142
Number of rings: 2

     

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