COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL333936
Chemical Name: 4-[({N'-cyano-N-[3-(trifluoromethyl)phenyl]carbamimidoyl}sulfanyl)methyl]benzoicacid
Smiles: N#C/N=C(/Nc1cccc(c1)C(F)(F)F)\SCc1ccc(cc1)C(=O)O

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Molecular Weight: 379.36
Empirical Formula: C17H12F3N3O2S

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 5.287
Rotatable bonds: 3
H-donors: 2
H-acceptors: 2
PSA: 110
Number of rings: 2

     

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