COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL505123
Chemical Name: (2Z)-3-(2,5-dimethoxyphenyl)-2-[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoicacid
Smiles: COc1ccc(cc1/C=C(/C(=O)O)\Sc1nnc([nH]1)C)OC

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Molecular Weight: 321.36
Empirical Formula: C14H15N3O4S

Physical State: Dry powder
Available Amount: 208 mg

Lipinsky:
logP: 3.059
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 122
Number of rings: 2

     

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