| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 26th, 2011 | 23 | Yes |
Popular Name: 1-[2-(1-allyl-2,5-dimethyl-pyrrol-3-yl)-2-oxo-ethyl]-N-methyl-piperidine-4-carboxamide 1-[2-(1-allyl-2,5-dimethyl-pyrro…
| 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) | 1.37 | 6.51 | -15.2 | 1 | 5 | 0 | 54 | 317.433 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.37 | 8.7 | -46.34 | 2 | 5 | 1 | 56 | 318.441 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
