In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 21 | Yes |
Popular Name: (1R,2R)-2-[4-(1-piperidyl)-1-piperidyl]-N-propyl-cyclopentanamine (1R,2R)-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 | 8.55 | -85.9 | 3 | 3 | 2 | 24 | 295.515 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.22 | 7.31 | -33.74 | 2 | 3 | 1 | 20 | 294.507 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.22 | 7.49 | -31.71 | 2 | 3 | 1 | 20 | 294.507 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.22 | 9.7 | -102.62 | 3 | 3 | 2 | 21 | 295.515 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.22 | 10.75 | -200.66 | 4 | 3 | 3 | 25 | 296.523 | 5 | ↓ |