In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 18 | Yes |
Popular Name: (1S,2R)-1-[(2S)-2-methylpyrrolidin-1-yl]-1-(p-tolyl)butan-2-amine (1S,2R)-1-[(2S)-2-methylpyrrolid…
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) | 2.85 | 5.48 | -38.05 | 3 | 2 | 1 | 31 | 247.406 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.85 | 7.19 | -31.05 | 3 | 2 | 1 | 30 | 247.406 | 4 | ↓ |