COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL002003
Chemical Name: 2-({(E)-[1-(4-nitrophenyl)-1H-pyrrol-2-yl]methylidene}amino)ethanol
Smiles: OCC/N=C/c1cccn1c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 259.26
Empirical Formula: C13H13N3O3

Physical State: Dry powder
Available Amount: 3078 mg

Lipinsky:
logP: 1.234
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 83
Number of rings: 2

     

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