COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL376425
Chemical Name: 2-({2-chloro-6-methoxy-4-[(E)-2-nitroethenyl]phenoxy}methyl)benzonitrile
Smiles: COc1cc(/C=C/[N+](=O)[O-])cc(c1OCc1ccccc1C#N)Cl

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Molecular Weight: 344.75
Empirical Formula: C17H13ClN2O4

Physical State: Dry powder
Available Amount: 763 mg

Lipinsky:
logP: 3.851
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 88
Number of rings: 2

     

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