COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK455601
Chemical Name: methyl5-ethyl-2-({[3-nitro-5-(2,2,3,3-tetrafluoropropoxy)phenyl]carbamothioyl}amino)thiophene-3-carboxylate
Smiles: CCc1sc(c(c1)C(=O)OC)NC(=S)Nc1cc(OCC(C(F)F)(F)F)cc(c1)[N+](=O)[O-]

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Molecular Weight: 495.48
Empirical Formula: C18H17F4N3O5S2

Physical State: Dry powder
Available Amount: 59 mg

Lipinsky:
logP: 6.606
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 165
Number of rings: 2

     

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