| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 20 | Yes |
Popular Name: (3R,6S)-1-[(1S,2R)-2-amino-1-(3-methyl-2-thienyl)propyl]-6-methyl-piperidine-3-carboxamide (3R,6S)-1-[(1S,2R)-2-amino-1-(3-…
| 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) | 1.24 | 2.13 | -51.86 | 5 | 4 | 1 | 74 | 296.46 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.24 | 3.33 | -28.29 | 5 | 4 | 1 | 74 | 296.46 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.24 | 1.86 | -6.47 | 4 | 4 | 0 | 72 | 295.452 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.24 | 3.61 | -116.69 | 6 | 4 | 2 | 75 | 297.468 | 4 | ↓ |
