| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 26th, 2010 | 17 | Yes |
Popular Name: (3S)-1-(2-isopropoxyethyl)-3-[(2S)-pyrrolidin-2-yl]piperidine (3S)-1-(2-isopropoxyethyl)-3-[(2…
| 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) | 2.01 | 4.76 | -37.11 | 2 | 3 | 1 | 29 | 241.399 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.01 | 6.19 | -29.27 | 2 | 3 | 1 | 26 | 241.399 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
