COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK219162
Chemical Name: propan-2-yl4-chloro-3-{[({5-[(2,6-dimethylphenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}benzoate
Smiles: O=C(Nc1cc(ccc1Cl)C(=O)OC(C)C)CSc1nnc(n1C)COc1c(C)cccc1C

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Molecular Weight: 503.02
Empirical Formula: C24H27ClN4O4S

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 5.642
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 120
Number of rings: 3

     

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