COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK126249
Chemical Name: propan-2-yl3-{[({5-[(2,6-dimethylphenoxy)methyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}benzoate
Smiles: CCn1c(SCC(=O)Nc2cccc(c2)C(=O)OC(C)C)nnc1COc1c(C)cccc1C

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Molecular Weight: 482.6
Empirical Formula: C25H30N4O4S

Physical State: Dry powder
Available Amount: 320 mg

Lipinsky:
logP: 6.006
Rotatable bonds: 9
H-donors: 1
H-acceptors: 4
PSA: 120
Number of rings: 3

     

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