COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK392772
Chemical Name: (2Z)-3-{5-bromo-2-[2-(4-methylphenoxy)ethoxy]phenyl}-2-(4-nitrophenyl)prop-2-enenitrile
Smiles: N#C/C(=C\c1cc(Br)ccc1OCCOc1ccc(cc1)C)/c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 479.33
Empirical Formula: C24H19BrN2O4

Physical State: Dry powder
Available Amount: 207 mg

Lipinsky:
logP: 7.498
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 88
Number of rings: 3

     

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