COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL040783
Chemical Name: 2-[(E)-(2-{[2-(4-ammonio-1,2,5-oxadiazol-3-yl)-1H-benzimidazol-1-yl]acetyl}hydrazinylidene)methyl]-4-nitrophenolate
Smiles: O=C(Cn1c(nc2c1cccc2)c1nonc1[NH3+])N/N=C/c1cc(ccc1[O-])[N+](=O)[O-]

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Molecular Weight: 422.36
Empirical Formula: C18H14N8O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.074
Rotatable bonds: 5
H-donors: 4
H-acceptors: 5
PSA: 194
Number of rings: 4

     

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