COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK807224
Chemical Name: methyl({5-[(1,3-benzodioxol-5-yloxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetate
Smiles: COC(=O)CSc1nnc(n1c1ccccc1)COc1ccc2c(c1)OCO2

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Molecular Weight: 399.43
Empirical Formula: C19H17N3O5S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.442
Rotatable bonds: 7
H-donors: 0
H-acceptors: 5
PSA: 110
Number of rings: 4

     

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