| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2011 | 18 | Yes |
Popular Name: (3S)-3-methyl-1-(3-pyrrolidin-1-ylpropyl)piperidine-3-carboxylic (3S)-3-methyl-1-(3-pyrrolidin-1-…
| 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) | 1.31 | 9.59 | -105.6 | 2 | 4 | 1 | 49 | 255.382 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.31 | 7.15 | -49.06 | 1 | 4 | 0 | 48 | 254.374 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.31 | 7.74 | -68.2 | 1 | 4 | 0 | 48 | 254.374 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
