| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2009 | 21 | Yes |
Popular Name: N-[3-(aminomethyl)phenyl]-2-[4-(2-hydroxyethyl)piperazin-1-yl]acetamide N-[3-(aminomethyl)phenyl]-2-[4-(…
| 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) | -0.07 | -0.1 | -90.22 | 6 | 6 | 2 | 85 | 294.399 | 6 | ↓ |
| Hi High (pH 8-9.5) | -0.07 | -2.86 | -10.94 | 4 | 6 | 0 | 82 | 292.383 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.07 | -2.46 | -54.88 | 5 | 6 | 1 | 83 | 293.391 | 6 | ↓ |
