COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL046730
Chemical Name: 3-[(E)-{2-[(1,3-benzoxazol-3-ium-2-ylsulfanyl)acetyl]hydrazinylidene}methyl]phenolate
Smiles: O=C(CSc1oc2c([nH+]1)cccc2)N/N=C/c1cccc(c1)[O-]

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Molecular Weight: 327.36
Empirical Formula: C16H13N3O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.366
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 117
Number of rings: 3

     

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