| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 19 | Yes |
Popular Name: (2S)-N'-ethyl-2-methyl-N'-(2-quinolylmethyl)propane-1,3-diamine (2S)-N'-ethyl-2-methyl-N'-(2-qui…
| 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) | 1.74 | 4.64 | -46.34 | 3 | 3 | 1 | 44 | 258.389 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.74 | 6.91 | -34.64 | 3 | 3 | 1 | 43 | 258.389 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.74 | 5.47 | -81.11 | 4 | 3 | 2 | 45 | 259.397 | 6 | ↓ |
