In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2011 | 20 | Yes |
Popular Name: (2R)-2-phenyl-3-[(3S)-3-pyrrolidin-1-ylpyrrolidin-1-yl]propan-1-amine (2R)-2-phenyl-3-[(3S)-3-pyrrolid…
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) | 1.77 | 6.17 | -89.67 | 4 | 3 | 2 | 35 | 275.44 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.77 | 3.78 | -43.46 | 3 | 3 | 1 | 34 | 274.432 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.77 | 8.47 | -198.66 | 5 | 3 | 3 | 37 | 276.448 | 5 | ↓ |