| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 20 | Yes |
Popular Name: (2R)-1-(4-allylpiperazin-1-yl)-2-amino-2-phenyl-propan-1-one (2R)-1-(4-allylpiperazin-1-yl)-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) | 1.64 | 3.6 | -7.6 | 2 | 4 | 0 | 50 | 273.38 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.64 | 3.84 | -45.98 | 3 | 4 | 1 | 51 | 274.388 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.64 | 6.1 | -103.74 | 4 | 4 | 2 | 52 | 275.396 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
