COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK541097
Chemical Name: (3E)-1,1,1-trifluoro-4-{[3-(4-{[(1E)-4,4,4-trifluoro-3-oxobut-1-en-1-yl]amino}phenoxy)phenyl]amino}but-3-en-2-one
Smiles: O=C(C(F)(F)F)/C=C/Nc1ccc(cc1)Oc1cccc(c1)N/C=C/C(=O)C(F)(F)F

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Molecular Weight: 444.33
Empirical Formula: C20H14F6N2O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.597
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 67
Number of rings: 2

     

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