| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 14th, 2010 | 16 | Yes |
Popular Name: (2S)-N1-methyl-N1-[(1-methylpyrazol-4-yl)methyl]-N2-propyl-propane-1,2-diamine (2S)-N1-methyl-N1-[(1-methylpyra…
| 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) | 1.11 | 4.59 | -39.6 | 2 | 4 | 1 | 38 | 225.36 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.11 | 2.95 | -4.79 | 1 | 4 | 0 | 33 | 224.352 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.11 | 6.46 | -119.67 | 3 | 4 | 2 | 39 | 226.368 | 7 | ↓ |
