COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL375662
Chemical Name: 2-{[4-(3,4-dimethylphenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(pyrrolidin-1-yl)ethanone
Smiles: O=C(N1CCCC1)CSc1nnc(n1c1ccc(c(c1)C)C)C

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Molecular Weight: 330.45
Empirical Formula: C17H22N4OS

Physical State: Dry powder
Available Amount: 233 mg

Lipinsky:
logP: 3.874
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 76
Number of rings: 3

     

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