COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL505133
Chemical Name: (2Z)-3-(3-methoxyphenyl)-2-[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoicacid
Smiles: COc1cccc(c1)/C=C(/C(=O)O)\Sc1nnc([nH]1)C

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Molecular Weight: 291.33
Empirical Formula: C13H13N3O3S

Physical State: Dry powder
Available Amount: 179 mg

Lipinsky:
logP: 3.004
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 113
Number of rings: 2

     

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