COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK202158
Chemical Name: 3-[({[4-ethyl-5-(1-{[(4-fluorophenyl)carbonyl]amino}-2-methylpropyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoicacid
Smiles: CCn1c(SCC(=O)Nc2cccc(c2)C(=O)O)nnc1C(C(C)C)NC(=O)c1ccc(cc1)F

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Molecular Weight: 499.57
Empirical Formula: C24H26FN5O4S

Physical State: Dry powder
Available Amount: 288 mg

Lipinsky:
logP: 5.184
Rotatable bonds: 9
H-donors: 3
H-acceptors: 4
PSA: 151
Number of rings: 3

     

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