COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL376827
Chemical Name: 2-({5-[(2,4-dichlorophenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(4-methylpiperidin-1-yl)ethanone
Smiles: CC1CCN(CC1)C(=O)CSc1nnc(n1C)COc1ccc(cc1Cl)Cl

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Molecular Weight: 429.37
Empirical Formula: C18H22Cl2N4O2S

Physical State: Dry powder
Available Amount: 723 mg

Lipinsky:
logP: 4.682
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 85
Number of rings: 3

     

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