COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK246227
Chemical Name: 2-({5-[(4-chlorophenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(3,4-dimethoxyphenyl)ethanone
Smiles: COc1cc(ccc1OC)C(=O)CSc1nnc(n1C)COc1ccc(cc1)Cl

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Molecular Weight: 433.92
Empirical Formula: C20H20ClN3O4S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.613
Rotatable bonds: 8
H-donors: 0
H-acceptors: 4
PSA: 100
Number of rings: 3

     

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