COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK045863
Chemical Name: 3,3-dimethyl-N-(2-methyl-4-nitrophenyl)butanamide
Smiles: O=C(CC(C)(C)C)Nc1ccc(cc1C)[N+](=O)[O-]

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Molecular Weight: 250.3
Empirical Formula: C13H18N2O3

Physical State: Dry powder
Available Amount: 239 mg

Lipinsky:
logP: 3.88
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 74
Number of rings: 1

     

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