| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2011 | 19 | Yes |
Popular Name: 1-(2,5-dimethyl-1H-pyrrol-3-yl)-2-[4-(methoxymethyl)-1-piperidyl]ethanone 1-(2,5-dimethyl-1H-pyrrol-3-yl)-…
| 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) | 1.53 | 7.21 | -35.02 | 2 | 4 | 1 | 47 | 265.377 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.53 | 5.04 | -7.31 | 1 | 4 | 0 | 45 | 264.369 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
