| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 18 | Yes |
Popular Name: [(2S,4S)-4-hydroxypyrrolidin-2-yl]-[4-[(1S)-1-methylpropyl]piperazin-1-yl]methanone [(2S,4S)-4-hydroxypyrrolidin-2-y…
| 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) | 0.02 | 0.23 | -41.57 | 3 | 5 | 1 | 60 | 256.37 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.02 | -0.96 | -11.54 | 2 | 5 | 0 | 56 | 255.362 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.02 | 2.05 | -96.71 | 4 | 5 | 2 | 62 | 257.378 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
