| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2010 | 17 | Yes |
Popular Name: (2S)-N2-methyl-N2-[(1-methylpyrazol-4-yl)methyl]-N1-propyl-butane-1,2-diamine (2S)-N2-methyl-N2-[(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) | 1.30 | 4.9 | -41.86 | 2 | 4 | 1 | 38 | 239.387 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.30 | 4.88 | -4.66 | 1 | 4 | 0 | 33 | 238.379 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.30 | 6.74 | -120.87 | 3 | 4 | 2 | 39 | 240.395 | 8 | ↓ |
