COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL382738
Chemical Name: (2E)-3-[4-(2-amino-2-oxoethoxy)phenyl]-N-(4-chloro-2-nitrophenyl)-2-cyanoprop-2-enamide
Smiles: N#C/C(=C\c1ccc(cc1)OCC(=O)N)/C(=O)Nc1ccc(cc1[N+](=O)[O-])Cl

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Molecular Weight: 400.78
Empirical Formula: C18H13ClN4O5

Physical State: Dry powder
Available Amount: 80 mg

Lipinsky:
logP: 3.291
Rotatable bonds: 3
H-donors: 3
H-acceptors: 5
PSA: 151
Number of rings: 2

     

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