COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK150748
Chemical Name: N-[(1E)-3-[(2E)-2-(3-bromo-2-hydroxy-5-nitrobenzylidene)hydrazinyl]-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl]benzamide
Smiles: O=C(/C(=C\c1cccs1)/NC(=O)c1ccccc1)N/N=C/c1cc(cc(c1O)Br)[N+](=O)[O-]

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Molecular Weight: 515.34
Empirical Formula: C21H15BrN4O5S

Physical State: Dry powder
Available Amount: 68 mg

Lipinsky:
logP: 6.259
Rotatable bonds: 4
H-donors: 3
H-acceptors: 5
PSA: 164
Number of rings: 3

     

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