COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL495474
Chemical Name: 3-nitro-N-[4-(prop-2-yn-1-yloxy)benzyl]aniline
Smiles: C#CCOc1ccc(cc1)CNc1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 282.3
Empirical Formula: C16H14N2O3

Physical State: Dry powder
Available Amount: 376 mg

Lipinsky:
logP: 3.376
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 67
Number of rings: 2

     

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