| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 4th, 2010 | 19 | Yes |
Popular Name: 5-(3-aminoprop-1-ynyl)-N-(1-methyl-4-piperidyl)thiophene-2-carboxamide 5-(3-aminoprop-1-ynyl)-N-(1-meth…
| 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) | 0.69 | 4.83 | -97.95 | 5 | 4 | 2 | 61 | 279.409 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.69 | 4.42 | -41.6 | 4 | 4 | 1 | 60 | 278.401 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
