| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2011 | 17 | Yes |
Popular Name: [(2S)-2-(3-hydroxypropyl)pyrrolidin-1-yl]-[(2R)-piperazin-2-yl]methanone [(2S)-2-(3-hydroxypropyl)pyrroli…
| 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) | -0.97 | -1.02 | -49.76 | 4 | 5 | 1 | 69 | 242.343 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.97 | -2.38 | -9.15 | 3 | 5 | 0 | 65 | 241.335 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
