COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK957116
Chemical Name: 4-[3-({N-ethyl-N'-[3-(trifluoromethyl)phenyl]carbamimidoyl}sulfanyl)-2,5-dioxopyrrolidin-1-yl]benzoicacid
Smiles: CCN/C(=N\c1cccc(c1)C(F)(F)F)/SC1CC(=O)N(C1=O)c1ccc(cc1)C(=O)O

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Molecular Weight: 465.45
Empirical Formula: C21H18F3N3O4S

Physical State: Dry powder
Available Amount: 37 mg

Lipinsky:
logP: 4.037
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 124
Number of rings: 3

     

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