| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 23 | Yes |
Popular Name: 2-[(3S)-4-(2-ethoxyethyl)-3-methyl-piperazin-1-yl]-N-(2-pyridylmethyl)acetamide 2-[(3S)-4-(2-ethoxyethyl)-3-meth…
| 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) | 0.76 | 3.97 | -34.41 | 2 | 6 | 1 | 59 | 321.445 | 8 | ↓ |
| Mid Mid (pH 6-8) | 0.76 | 1.74 | -9.98 | 1 | 6 | 0 | 58 | 320.437 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 0.76 | 4.38 | -76.12 | 3 | 6 | 2 | 60 | 322.453 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
