| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 16th, 2011 | 16 | Yes |
Popular Name: 1-[(3S)-3-ethyl-3-piperidyl]-N-(2-thienylmethyl)methanamine 1-[(3S)-3-ethyl-3-piperidyl]-N-(…
| 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) | 2.18 | 5.23 | -38.51 | 3 | 2 | 1 | 29 | 239.408 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.18 | 6.32 | -101.93 | 4 | 2 | 2 | 33 | 240.416 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
