| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 18 | Yes |
Popular Name: 1-prop-2-ynyl-N-(1,3,5-trimethylpyrazol-4-yl)piperidin-4-amine 1-prop-2-ynyl-N-(1,3,5-trimethyl…
| 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) | 1.86 | 4.39 | -7.39 | 1 | 4 | 0 | 33 | 246.358 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.86 | 6.67 | -40.61 | 2 | 4 | 1 | 34 | 247.366 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.86 | 6.8 | -78.13 | 3 | 4 | 2 | 36 | 248.374 | 3 | ↓ |
