| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 23 | No |
Popular Name: 1-[(3R)-3-(2-hydroxyethyl)-4-isobutyl-piperazin-1-yl]-3-(oxazinan-2-yl)propan-1-one 1-[(3R)-3-(2-hydroxyethyl)-4-iso…
| 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) | 0.96 | 3.87 | -43.48 | 2 | 6 | 1 | 57 | 328.477 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.96 | 2.91 | -8.37 | 1 | 6 | 0 | 56 | 327.469 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
