COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL040555
Chemical Name: 4-({[4-ammonio-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzoate
Smiles: COc1ccc(cc1)c1nnc(n1[NH3+])SCc1ccc(cc1)C(=O)[O-]

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Molecular Weight: 356.41
Empirical Formula: C17H16N4O3S

Physical State: Dry powder
Available Amount: 15 mg

Lipinsky:
logP: 3.97
Rotatable bonds: 2
H-donors: 3
H-acceptors: 3
PSA: 133
Number of rings: 3

     

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