BDBM228824 2-(5-Fluoro-2-(prop-2-yn-1-ylcarbamoyl)phenoxy)acetic acid (5)
SMILES: OC(=O)COc1cc(F)ccc1C(=O)NCC#C
InChI Key: InChIKey=PZTOBGBKDQCKIG-UHFFFAOYSA-N
Cell (A) | Syringe (B) | Cell Links | Syringe Links | Cell + Syr Links | ΔG° kcal/mole | -TΔS° kcal/mole | ΔH° kcal/mole | log K | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|
Aldose reductase (AR) (Homo sapiens (Human)) | BDBM228824 (2-(5-Fluoro-2-(prop-2-yn-1-ylcarbamoyl)phenoxy)ace...) | GoogleScholar PDB | PC cid PC sid PDB | -7.52 | -3.51 | -11.0 | 8.55 | 8 | 24.9 | |
Philipps-Universität Marburg | ACS Chem Biol 12: 1397-1415 (2017) |