In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 19 | Yes |
Popular Name: (2S)-2-[(3S)-3-(1-piperidyl)pyrrolidin-1-yl]-N-propyl-butan-1-amine (2S)-2-[(3S)-3-(1-piperidyl)pyrr…
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) | 2.58 | 7.37 | -87.22 | 3 | 3 | 2 | 24 | 269.477 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.58 | 5.21 | -34.43 | 2 | 3 | 1 | 23 | 268.469 | 7 | ↓ |