COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL495477
Chemical Name: N-[3,5-dichloro-4-(prop-2-yn-1-yloxy)benzyl]-3-nitroaniline
Smiles: C#CCOc1c(Cl)cc(cc1Cl)CNc1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 351.19
Empirical Formula: C16H12Cl2N2O3

Physical State: Dry powder
Available Amount: 109 mg

Lipinsky:
logP: 4.479
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 67
Number of rings: 2

     

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