| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 17 | Yes |
Popular Name: (2S)-N1,N1-diethyl-N2-[(1S)-1-(2-pyridyl)ethyl]propane-1,2-diamine (2S)-N1,N1-diethyl-N2-[(1S)-1-(2…
| 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) | 2.00 | 5.62 | -29.1 | 2 | 3 | 1 | 33 | 236.383 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.00 | 6.51 | -32.59 | 2 | 3 | 1 | 29 | 236.383 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.00 | 6.92 | -80.74 | 3 | 3 | 2 | 31 | 237.391 | 7 | ↓ |
