| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2008 | 20 | Yes |
Popular Name: N'-benzyl-N,N-dimethyl-N'-(3-pyridylmethyl)ethane-1,2-diamine N'-benzyl-N,N-dimethyl-N'-(3-pyr…
| 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) | 1.93 | 8.21 | -41.48 | 1 | 3 | 1 | 21 | 270.4 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.93 | 7.89 | -40.03 | 1 | 3 | 1 | 21 | 270.4 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.93 | 5.68 | -4.89 | 0 | 3 | 0 | 19 | 269.392 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.93 | 8.65 | -89.36 | 2 | 3 | 2 | 22 | 271.408 | 7 | ↓ |
