In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 20 | No |
Popular Name: 3-fluoro-4-[[propyl(2,2,2-trifluoroethyl)amino]methyl]benzenecarbothioamide 3-fluoro-4-[[propyl(2,2,2-triflu…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.44 | 5.93 | -11.25 | 2 | 2 | 0 | 29 | 308.344 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.44 | 8.14 | -50.97 | 3 | 2 | 1 | 30 | 309.352 | 7 | ↓ |