In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 20 | Yes |
Popular Name: (3R)-3-[(3,4-difluorophenyl)methylamino]-3-(2-thienyl)propanoic (3R)-3-[(3,4-difluorophenyl)meth…
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) | 2.75 | 8.5 | -51.92 | 2 | 3 | 0 | 57 | 297.326 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.75 | 7.32 | -43.78 | 1 | 3 | -1 | 52 | 296.318 | 6 | ↓ |