| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 16 | Yes |
Popular Name: (2S)-N1,N1-diethyl-N2-[(1S)-1-(1H-pyrazol-3-yl)ethyl]propane-1,2-diamine (2S)-N1,N1-diethyl-N2-[(1S)-1-(1…
| 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) | 1.79 | 4.53 | -33.84 | 3 | 4 | 1 | 45 | 225.36 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.79 | 3.65 | -37.18 | 3 | 4 | 1 | 49 | 225.36 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.79 | 5.74 | -115.53 | 4 | 4 | 2 | 50 | 226.368 | 7 | ↓ |
