COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK532056
Chemical Name: [(4-{[(E)-1,3-benzodioxol-5-ylmethylidene]amino}-5-propyl-4H-1,2,4-triazol-3-yl)sulfanyl]aceticacid
Smiles: CCCc1nnc(n1/N=C/c1ccc2c(c1)OCO2)SCC(=O)O

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Molecular Weight: 348.38
Empirical Formula: C15H16N4O4S

Physical State: Dry powder
Available Amount: 283 mg

Lipinsky:
logP: 2.876
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 124
Number of rings: 3

     

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