COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL417492
Chemical Name: 1,3-dichloro-5-[(E)-2-nitroethenyl]-2-(prop-2-yn-1-yloxy)benzene
Smiles: C#CCOc1c(Cl)cc(cc1Cl)/C=C/[N+](=O)[O-]

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Molecular Weight: 272.09
Empirical Formula: C11H7Cl2NO3

Physical State: Dry powder
Available Amount: 78 mg

Lipinsky:
logP: 3.25
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 55
Number of rings: 1

     

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