| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 13th, 2008 | 20 | Yes |
Popular Name: (2S)-N-[3-(aminomethyl)phenyl]-2-(4-methylpiperazin-1-yl)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) | 0.53 | 2.83 | -87.5 | 5 | 5 | 2 | 64 | 278.4 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.53 | 0.07 | -8.8 | 3 | 5 | 0 | 62 | 276.384 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.53 | 0.4 | -55.68 | 4 | 5 | 1 | 63 | 277.392 | 4 | ↓ |
