COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL002904
Chemical Name: (4E)-4-(hydroxyimino)-3-oxo-3,4-dihydronaphthalene-2,7-disulfonate
Smiles: O/N=C/1\c2ccc(cc2C=C(C1=O)S(=O)(=O)[O-])S(=O)(=O)[O-]

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Saltdata: 2Na+
Molecular Weight: 331.28
Empirical Formula: C10H5NO8S2

Physical State: Dry powder
Available Amount: 3589 mg

Lipinsky:
logP: -0.611
Rotatable bonds: 1
H-donors: 1
H-acceptors: 8
PSA: 180
Number of rings: 2

     

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