| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 13th, 2008 | 18 | Yes |
Popular Name: (2S)-N-[3-(aminomethyl)phenyl]-2-(isopropyl-methyl-amino)propanamide (2S)-N-[3-(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) | 1.31 | 4.39 | -90.51 | 5 | 4 | 2 | 61 | 251.374 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.31 | 2.3 | -57.32 | 4 | 4 | 1 | 60 | 250.366 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.31 | 3.99 | -34.74 | 4 | 4 | 1 | 60 | 250.366 | 5 | ↓ |
