| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 17 | Yes |
Popular Name: (2S)-N1,N1-diethyl-N2-[(1S)-1-(1-methylpyrazol-4-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) | 1.55 | 5.94 | -36.73 | 2 | 4 | 1 | 34 | 239.387 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.55 | 5.33 | -34.75 | 2 | 4 | 1 | 38 | 239.387 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.55 | 7.02 | -110.91 | 3 | 4 | 2 | 39 | 240.395 | 7 | ↓ |
