| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2009 | 18 | Yes |
Popular Name: (2S)-2-methyl-3-(4-pyrimidin-2-ylpiperazin-1-yl)propanamidine (2S)-2-methyl-3-(4-pyrimidin-2-y…
| 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) | 0.48 | 6.03 | -106.06 | 5 | 6 | 2 | 85 | 250.35 | 4 | ↓ |
| Hi High (pH 8-9.5) | -2.81 | 4.57 | -8.92 | 4 | 6 | 0 | 84 | 248.334 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.48 | 4.03 | -37.93 | 4 | 6 | 1 | 84 | 249.342 | 4 | ↓ |
| Mid Mid (pH 6-8) | -2.81 | 6.25 | -31.65 | 5 | 6 | 1 | 85 | 249.342 | 4 | ↓ |
