| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2011 | 14 | Yes |
Popular Name: [(2S)-2-methylpyrrolidin-1-yl]-[(2R)-piperazin-2-yl]methanone [(2S)-2-methylpyrrolidin-1-yl]-[…
| 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) | -0.54 | 0.84 | -48.02 | 3 | 4 | 1 | 49 | 198.29 | 1 | ↓ |
| Hi High (pH 8-9.5) | -0.54 | -0.52 | -7.7 | 2 | 4 | 0 | 44 | 197.282 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
