| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 25th, 2009 | 22 | Yes |
Popular Name: (1S)-N,N-diethyl-1-(p-tolyl)-N'-(3-pyridylmethyl)ethane-1,2-diamine (1S)-N,N-diethyl-1-(p-tolyl)-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) | 3.07 | 9.31 | -37.32 | 2 | 3 | 1 | 29 | 298.454 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.07 | 8.16 | -43.81 | 2 | 3 | 1 | 33 | 298.454 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.07 | 10.68 | -124.19 | 3 | 3 | 2 | 34 | 299.462 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.07 | 9.74 | -85.31 | 3 | 3 | 2 | 31 | 299.462 | 8 | ↓ |
