| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2011 | 15 | No |
Popular Name: 1-[(3R)-1-[[(2R)-oxiran-2-yl]methyl]pyrrolidin-3-yl]piperidine 1-[(3R)-1-[[(2R)-oxiran-2-yl]met…
| 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) | 1.23 | 3.6 | -35.45 | 1 | 3 | 1 | 20 | 211.329 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.23 | 1.43 | -4.16 | 0 | 3 | 0 | 19 | 210.321 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.23 | 5.96 | -107.88 | 2 | 3 | 2 | 21 | 212.337 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
