| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 16 | Yes |
Popular Name: (3S)-N3-ethyl-N1-methyl-N1-(2-pyridylmethyl)butane-1,3-diamine (3S)-N3-ethyl-N1-methyl-N1-(2-py…
| 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) | 1.33 | 4.3 | -37.92 | 2 | 3 | 1 | 33 | 222.356 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.33 | 5.6 | -31.86 | 2 | 3 | 1 | 29 | 222.356 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.33 | 5.03 | -80.13 | 3 | 3 | 2 | 34 | 223.364 | 7 | ↓ |
