COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL308128
Chemical Name: (2E)-2-cyano-N-{[2-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)naphthalen-1-yl]carbamoyl}-3-(4-methoxyphenyl)prop-2-enamide
Smiles: N#C/C(=C\c1ccc(cc1)OC)/C(=O)NC(=O)Nc1c2ccccc2ccc1C(C(F)(F)F)(C(F)(F)F)O

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Molecular Weight: 537.42
Empirical Formula: C25H17F6N3O4

Physical State: Dry powder
Available Amount: 249 mg

Lipinsky:
logP: 5.584
Rotatable bonds: 3
H-donors: 3
H-acceptors: 4
PSA: 111
Number of rings: 3

     

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