COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK522789
Chemical Name: (2E)-2-cyano-3-{3,5-dichloro-4-[(2-chlorobenzyl)oxy]phenyl}-N-(2-methoxy-4-nitrophenyl)prop-2-enamide
Smiles: N#C/C(=C\c1cc(Cl)c(c(c1)Cl)OCc1ccccc1Cl)/C(=O)Nc1ccc(cc1OC)[N+](=O)[O-]

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Molecular Weight: 532.77
Empirical Formula: C24H16Cl3N3O5

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 7.362
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 117
Number of rings: 3

     

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