In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 21 | Yes |
Popular Name: (1S,2S)-2-[4-(1-piperidyl)-1-piperidyl]-N-propyl-cyclopentanamine (1S,2S)-2-[4-(1-piperidyl)-1-pip…
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) | 3.22 | 8.5 | -85.03 | 3 | 3 | 2 | 24 | 295.515 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.22 | 7.37 | -30.07 | 2 | 3 | 1 | 20 | 294.507 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.22 | 7.36 | -30.85 | 2 | 3 | 1 | 20 | 294.507 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.22 | 9.55 | -98.03 | 3 | 3 | 2 | 21 | 295.515 | 5 | ↓ |