| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 18 | Yes |
Popular Name: (3S)-1-[(1S)-2-amino-1-(3-methyl-2-thienyl)ethyl]piperidine-3-carboxamide (3S)-1-[(1S)-2-amino-1-(3-methyl…
| 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) | 0.51 | 0.46 | -52.72 | 5 | 4 | 1 | 74 | 268.406 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.51 | -0.34 | -8.46 | 4 | 4 | 0 | 72 | 267.398 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.51 | 1.83 | -33.88 | 5 | 4 | 1 | 74 | 268.406 | 4 | ↓ |
