COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK182318
Chemical Name: (2E)-3-(3-bromo-4-hydroxy-5-nitrophenyl)-2-cyano-N-(naphthalen-2-yl)prop-2-enamide
Smiles: N#C/C(=C\c1cc(Br)c(c(c1)[N+](=O)[O-])O)/C(=O)Nc1ccc2c(c1)cccc2

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Molecular Weight: 438.24
Empirical Formula: C20H12BrN3O4

Physical State: Dry powder
Available Amount: 129 mg

Lipinsky:
logP: 5.33
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 118
Number of rings: 3

     

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