| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 18 | Yes |
Popular Name: (3S)-1-[(1R)-2-amino-1-(5-chloro-2-thienyl)ethyl]piperidine-3-carboxamide (3S)-1-[(1R)-2-amino-1-(5-chloro…
| 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) | 0.93 | 1.15 | -50.32 | 5 | 4 | 1 | 74 | 288.824 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.93 | 0.01 | -9.1 | 4 | 4 | 0 | 72 | 287.816 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.93 | 2.21 | -40.83 | 5 | 4 | 1 | 74 | 288.824 | 4 | ↓ |
