| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2010 | 21 | Yes |
Popular Name: 2-[2-dimethylaminoethyl(isobutyl)amino]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone 2-[2-dimethylaminoethyl(isobutyl…
| 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) | 2.00 | 9.51 | -40.17 | 1 | 4 | 1 | 30 | 294.463 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.00 | 6.95 | -6.09 | 0 | 4 | 0 | 28 | 293.455 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.00 | 8.79 | -33.09 | 1 | 4 | 1 | 30 | 294.463 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.00 | 11.25 | -112.09 | 2 | 4 | 2 | 31 | 295.471 | 8 | ↓ |
