| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2009 | 17 | Yes |
Popular Name: 1-(4-hydroxyphenyl)-2-[methyl-[(2R)-2-methylbutyl]amino]ethanone 1-(4-hydroxyphenyl)-2-[methyl-[(…
| 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) | 2.64 | 6.39 | -42.31 | 2 | 3 | 1 | 42 | 236.335 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.64 | 5.28 | -42.19 | 0 | 3 | -1 | 43 | 234.319 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.64 | 7.16 | -61.44 | 1 | 3 | 0 | 45 | 235.327 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.64 | 4.5 | -7.68 | 1 | 3 | 0 | 41 | 235.327 | 6 | ↓ |
