| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2008 | 20 | Yes |
Popular Name: (2S)-N-[(3-fluorophenyl)methyl]-N-methyl-3-phenyl-propane-1,2-diamine (2S)-N-[(3-fluorophenyl)methyl]-…
| 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) | 2.55 | 7.29 | -44.38 | 3 | 2 | 1 | 31 | 273.375 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.55 | 6.53 | -4.19 | 2 | 2 | 0 | 29 | 272.367 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.55 | 9.06 | -40.59 | 3 | 2 | 1 | 30 | 273.375 | 6 | ↓ |
