| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2011 | 21 | Yes |
Popular Name: (2S)-1-[4-[(2S)-2-hydroxybutyl]piperazin-1-yl]-2-morpholino-propan-1-one (2S)-1-[4-[(2S)-2-hydroxybutyl]p…
| 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) | 0.00 | -0.94 | -8.89 | 1 | 6 | 0 | 56 | 299.415 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.00 | 1.34 | -46.07 | 2 | 6 | 1 | 57 | 300.423 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.00 | 3.78 | -96.86 | 3 | 6 | 2 | 59 | 301.431 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
