| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 17 | Yes |
Popular Name: (2S)-N',N',4-trimethyl-N-[(1-methylpyrazol-4-yl)methyl]pentane-1,2-diamine (2S)-N',N',4-trimethyl-N-[(1-met…
| 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) | 1.54 | 4.76 | -45.1 | 2 | 4 | 1 | 38 | 239.387 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.54 | 3.55 | -4.77 | 1 | 4 | 0 | 33 | 238.379 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.54 | 6.88 | -117.63 | 3 | 4 | 2 | 39 | 240.395 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.54 | 5.65 | -39.75 | 2 | 4 | 1 | 34 | 239.387 | 7 | ↓ |
