| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 22 | Yes |
Popular Name: 1-[2-[4-[(2R)-2-hydroxy-3,3-dimethyl-butyl]piperazin-1-yl]-2-oxo-ethyl]pyrrolidin-2-one 1-[2-[4-[(2R)-2-hydroxy-3,3-dime…
| 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) | 0.37 | 2.79 | -16.09 | 1 | 6 | 0 | 64 | 311.426 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.37 | 5.02 | -53.49 | 2 | 6 | 1 | 65 | 312.434 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
