| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 14 | Yes |
Popular Name: [(2R,3S)-1-methyl-2-(3-thienyl)-3-piperidyl]methanamine [(2R,3S)-1-methyl-2-(3-thienyl)-…
| 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) | 1.09 | 2.81 | -42.56 | 3 | 2 | 1 | 31 | 211.354 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.09 | 4.98 | -100.53 | 4 | 2 | 2 | 32 | 212.362 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
