COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK054450
Chemical Name: 3,3-dimethyl-N-(6-nitro-1,3-benzothiazol-2-yl)butanamide
Smiles: O=C(CC(C)(C)C)Nc1nc2c(s1)cc(cc2)[N+](=O)[O-]

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Molecular Weight: 293.35
Empirical Formula: C13H15N3O3S

Physical State: Dry powder
Available Amount: 193 mg

Lipinsky:
logP: 3.332
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 116
Number of rings: 2

     

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