COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL122499
Chemical Name: 2-{[5-(1,3-benzodioxol-5-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(trifluoromethyl)phenyl]acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)C(F)(F)F)nnc1c1ccc2c(c1)OCO2

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Molecular Weight: 450.44
Empirical Formula: C20H17F3N4O3S

Physical State: Dry powder
Available Amount: 109 mg

Lipinsky:
logP: 5.255
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 103
Number of rings: 4

     

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