In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 21 | Yes |
Popular Name: (1R)-N'-isobutyl-N'-(2-methoxyethyl)-1-(4-methoxyphenyl)-N-methyl-ethane-1,2-diamine (1R)-N'-isobutyl-N'-(2-methoxyet…
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) | 2.87 | 7.34 | -112.48 | 3 | 4 | 2 | 40 | 296.455 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.87 | 7.59 | -40.66 | 2 | 4 | 1 | 38 | 295.447 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.87 | 7.96 | -35.26 | 2 | 4 | 1 | 35 | 295.447 | 10 | ↓ |