| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 28th, 2010 | 21 | Yes |
Popular Name: [4-[(3S)-3-propoxy-1-piperidyl]-1-propyl-4-piperidyl]methanamine [4-[(3S)-3-propoxy-1-piperidyl]-…
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|
| Hi High (pH 8-9.5) | 1.77 | 6.95 | -96.64 | 4 | 4 | 2 | 44 | 299.503 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.77 | 4.64 | -36.31 | 3 | 4 | 1 | 43 | 298.495 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.77 | 4.71 | -29.83 | 3 | 4 | 1 | 43 | 298.495 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.77 | 7.26 | -222.21 | 5 | 4 | 3 | 46 | 300.511 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.77 | 5.39 | -109.42 | 4 | 4 | 2 | 45 | 299.503 | 7 | ↓ |
