COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK699984
Chemical Name: 5-bromo-N-[(1E)-3-[(2-hydroxyethyl)amino]-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]furan-2-carboxamide
Smiles: OCCNC(=O)/C(=C\c1cccc(c1)[N+](=O)[O-])/NC(=O)c1ccc(o1)Br

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Molecular Weight: 424.21
Empirical Formula: C16H14BrN3O6

Physical State: Dry powder
Available Amount: 222 mg

Lipinsky:
logP: 0.921
Rotatable bonds: 6
H-donors: 3
H-acceptors: 6
PSA: 137
Number of rings: 2

     

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