| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2009 | 20 | Yes |
Popular Name: (1S)-1-(3-methoxyphenyl)-N'-methyl-N'-(3-pyridylmethyl)ethane-1,2-diamine (1S)-1-(3-methoxyphenyl)-N'-meth…
| 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) | -0.35 | 3.89 | -46.87 | 3 | 4 | 1 | 53 | 272.372 | 6 | ↓ |
| Hi High (pH 8-9.5) | -0.35 | 3.54 | -5.98 | 2 | 4 | 0 | 51 | 271.364 | 6 | ↓ |
| Lo Low (pH 4.5-6) | -0.35 | 5.9 | -138.94 | 4 | 4 | 2 | 54 | 273.38 | 6 | ↓ |
| Lo Low (pH 4.5-6) | -0.35 | 4.36 | -104.22 | 4 | 4 | 2 | 54 | 273.38 | 6 | ↓ |
