| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 18 | Yes |
Popular Name: (1S)-N-benzyl-N-methyl-1-(1-methylpyrazol-4-yl)ethane-1,2-diamine (1S)-N-benzyl-N-methyl-1-(1-meth…
| 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) | 0.51 | 5.88 | -34.06 | 3 | 4 | 1 | 48 | 245.35 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.50 | 3.53 | -6.93 | 2 | 4 | 0 | 47 | 244.342 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.51 | 3.66 | -55.55 | 3 | 4 | 1 | 49 | 245.35 | 5 | ↓ |
