COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK139986
Chemical Name: N-{1-[4-ethyl-5-({2-oxo-2-[(2,4,6-trimethylphenyl)amino]ethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]-2-methylpropyl}-3-methylbenzamide
Smiles: CCn1c(SCC(=O)Nc2c(C)cc(cc2C)C)nnc1C(C(C)C)NC(=O)c1cccc(c1)C

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Molecular Weight: 493.67
Empirical Formula: C27H35N5O2S

Physical State: Dry powder
Available Amount: 75 mg

Lipinsky:
logP: 6.062
Rotatable bonds: 8
H-donors: 2
H-acceptors: 2
PSA: 114
Number of rings: 3

     

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