| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2011 | 21 | Yes |
Popular Name: (2R,3S)-3-phenyl-2-[(3S)-3-pyrrolidin-1-ylpyrrolidin-1-yl]butan-1-amine (2R,3S)-3-phenyl-2-[(3S)-3-pyrro…
| 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) | 2.29 | 6.97 | -109.6 | 4 | 3 | 2 | 35 | 289.467 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.29 | 4.57 | -39.03 | 3 | 3 | 1 | 34 | 288.459 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
