COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL047466
Chemical Name: {2-[(E)-{2-[(1,3-benzoxazol-3-ium-2-ylsulfanyl)acetyl]hydrazinylidene}methyl]phenoxy}acetate
Smiles: O=C(CSc1oc2c([nH+]1)cccc2)N/N=C/c1ccccc1OCC(=O)[O-]

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Molecular Weight: 385.4
Empirical Formula: C18H15N3O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.688
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 143
Number of rings: 3

     

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