| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 18 | Yes |
Popular Name: (2S)-N2-ethyl-N1,3,3-trimethyl-N1-(4-pyridylmethyl)butane-1,2-diamine (2S)-N2-ethyl-N1,3,3-trimethyl-N…
| 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) | 2.30 | 7.85 | -120.1 | 3 | 3 | 2 | 34 | 251.418 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.30 | 7.48 | -35.93 | 2 | 3 | 1 | 33 | 250.41 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.30 | 6.78 | -37.56 | 2 | 3 | 1 | 29 | 250.41 | 7 | ↓ |
