| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 17 | Yes |
Popular Name: (1S,2R)-1-(4-fluorophenyl)-N1-isobutyl-N1-methyl-propane-1,2-diamine (1S,2R)-1-(4-fluorophenyl)-N1-is…
| 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) | 2.42 | 7.41 | -123.2 | 4 | 2 | 2 | 32 | 240.366 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.42 | 7.15 | -37.03 | 3 | 2 | 1 | 30 | 239.358 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.42 | 4.72 | -44.35 | 3 | 2 | 1 | 31 | 239.358 | 5 | ↓ |
