COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL055543
Chemical Name: 2-(1,3-benzoxazol-3-ium-2-yl)-4-{[(3-methylbutanoyl)carbamothioyl]amino}phenolate
Smiles: CC(CC(=O)NC(=S)Nc1ccc(c(c1)c1oc2c([nH+]1)cccc2)[O-])C

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Molecular Weight: 369.44
Empirical Formula: C19H19N3O3S

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 4.877
Rotatable bonds: 3
H-donors: 3
H-acceptors: 3
PSA: 123
Number of rings: 3

     

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