| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2011 | 20 | Yes |
Popular Name: 2-(allylamino)-1-(1-cyclohexyl-2,5-dimethyl-pyrrol-3-yl)ethanone 2-(allylamino)-1-(1-cyclohexyl-2…
| 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) | 2.80 | 9.52 | -36.92 | 2 | 3 | 1 | 39 | 275.416 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.80 | 8.15 | -6.39 | 1 | 3 | 0 | 34 | 274.408 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
