In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: 1-(4-ethylphenyl)-2-[isopentyl(methyl)amino]ethanone 1-(4-ethylphenyl)-2-[isopentyl(m…
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) | 4.06 | 10.61 | -39.78 | 1 | 2 | 1 | 22 | 248.39 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.06 | 8.33 | -6.23 | 0 | 2 | 0 | 20 | 247.382 | 7 | ↓ |