In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 20 | Yes |
Popular Name: (1R,2S)-2-[(3S)-3-methylpyrrolidin-1-yl]-N-propyl-1-(p-tolyl)propan-1-amine (1R,2S)-2-[(3S)-3-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) | 4.25 | 10.78 | -108.14 | 3 | 2 | 2 | 21 | 276.468 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.25 | 8.63 | -29.07 | 2 | 2 | 1 | 16 | 275.46 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.25 | 10.19 | -32.63 | 2 | 2 | 1 | 20 | 275.46 | 6 | ↓ |