COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK393627
Chemical Name: 4-{(E)-[2-(N'-nitrocarbamimidoyl)hydrazinylidene]methyl}phenyl2-chloro-4,5-difluorobenzoate
Smiles: [O-][N+](=O)/N=C(/N/N=C/c1ccc(cc1)OC(=O)c1cc(F)c(cc1Cl)F)\N

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Molecular Weight: 397.73
Empirical Formula: C15H10ClF2N5O4

Physical State: Dry powder
Available Amount: 176 mg

Lipinsky:
logP: 3.249
Rotatable bonds: 3
H-donors: 3
H-acceptors: 4
PSA: 134
Number of rings: 2

     

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