| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 30th, 2010 | 21 | Yes |
Popular Name: (2S)-N-[2-(aminomethyl)phenyl]-2-[isobutyl(isopropyl)amino]propanamide (2S)-N-[2-(aminomethyl)phenyl]-2…
| 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) | 2.41 | 6.38 | -105.58 | 5 | 4 | 2 | 61 | 293.455 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.41 | 5.88 | -32.6 | 4 | 4 | 1 | 60 | 292.447 | 7 | ↓ |
