COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK138350
Chemical Name: 4-[(2-{(Z)-2-carboxy-2-[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethenyl}phenoxy)methyl]benzoicacid
Smiles: OC(=O)/C(=C/c1ccccc1OCc1ccc(cc1)C(=O)O)/Sc1nnc([nH]1)C

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Molecular Weight: 411.44
Empirical Formula: C20H17N3O5S

Physical State: Dry powder
Available Amount: 247 mg

Lipinsky:
logP: 4.366
Rotatable bonds: 8
H-donors: 3
H-acceptors: 5
PSA: 150
Number of rings: 3

     

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