In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: 1-(4-hydroxyphenyl)-2-[methyl-[[(2R)-tetrahydrofuran-2-yl]methyl]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) | 1.39 | 4.68 | -42.53 | 2 | 4 | 1 | 51 | 250.318 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.39 | 3.12 | -45.69 | 0 | 4 | -1 | 53 | 248.302 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.39 | 2.35 | -11.05 | 1 | 4 | 0 | 50 | 249.31 | 5 | ↓ |