In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 15 | Yes |
Popular Name: 1-(2,4-dihydroxyphenyl)-2-[ethyl(methyl)amino]ethanone 1-(2,4-dihydroxyphenyl)-2-[ethyl…
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) | 1.30 | 2.75 | -42.74 | 3 | 4 | 1 | 62 | 210.253 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.30 | 1.5 | -53.06 | 1 | 4 | -1 | 64 | 208.237 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.30 | 0.49 | -9.83 | 2 | 4 | 0 | 61 | 209.245 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.30 | 3.76 | -58.62 | 2 | 4 | 0 | 65 | 209.245 | 4 | ↓ |