COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL000444
Chemical Name: 3-{[3-(1H-benzotriazol-1-yl)-1,4-dioxo-1,4-dihydronaphthalen-2-yl]amino}phenylbenzenesulfonate
Smiles: O=C1c2ccccc2C(=O)C(=C1Nc1cccc(c1)OS(=O)(=O)c1ccccc1)n1nnc2c1cccc2

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Molecular Weight: 522.54
Empirical Formula: C28H18N4O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.689
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 128
Number of rings: 6

     

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