In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2011 | 16 | Yes |
Popular Name: (3S)-3-pyrrolidin-1-yl-1-[[(3R)-pyrrolidin-3-yl]methyl]pyrrolidine (3S)-3-pyrrolidin-1-yl-1-[[(3R)-…
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) | 1.18 | 4.39 | -81.28 | 3 | 3 | 2 | 24 | 225.38 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.18 | 2.01 | -38.02 | 2 | 3 | 1 | 23 | 224.372 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.18 | 7.05 | -185.41 | 4 | 3 | 3 | 25 | 226.388 | 3 | ↓ |