| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 21 | Yes |
Popular Name: 1-[(1S,2S)-2-amino-1-(3-methyl-2-thienyl)butyl]-N-methyl-piperidine-4-carboxamide 1-[(1S,2S)-2-amino-1-(3-methyl-2…
| 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) | 1.82 | 3.73 | -40.05 | 4 | 4 | 1 | 60 | 310.487 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.82 | 3.38 | -7.56 | 3 | 4 | 0 | 58 | 309.479 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.82 | 5.72 | -119.87 | 5 | 4 | 2 | 61 | 311.495 | 5 | ↓ |
