COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK118734
Chemical Name: 4-butoxy-N-{3-[4-methyl-5-({1-oxo-1-[(2,4,6-trimethylphenyl)amino]propan-2-yl}sulfanyl)-4H-1,2,4-triazol-3-yl]phenyl}benzamide
Smiles: CCCCOc1ccc(cc1)C(=O)Nc1cccc(c1)c1nnc(n1C)SC(C(=O)Nc1c(C)cc(cc1C)C)C

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Molecular Weight: 571.74
Empirical Formula: C32H37N5O3S

Physical State: Dry powder
Available Amount: 121 mg

Lipinsky:
logP: 8.059
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 123
Number of rings: 4

     

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