| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 21 | Yes |
Popular Name: (1S)-1-(4-methoxyphenyl)-N,N'-dimethyl-N'-(2-pyridylmethyl)ethane-1,2-diamine (1S)-1-(4-methoxyphenyl)-N,N'-di…
| 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) | 1.99 | 5.72 | -37.28 | 2 | 4 | 1 | 42 | 286.399 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.99 | 4 | -6.63 | 1 | 4 | 0 | 37 | 285.391 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.99 | 6.44 | -92.22 | 3 | 4 | 2 | 43 | 287.407 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.99 | 7.65 | -121.82 | 3 | 4 | 2 | 43 | 287.407 | 7 | ↓ |
