| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 15th, 2011 | 17 | Yes |
Popular Name: (1R)-N'-(4-methylpyrimidin-2-yl)-1-phenyl-ethane-1,2-diamine (1R)-N'-(4-methylpyrimidin-2-yl)…
| 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) | -0.05 | 5.83 | -45.77 | 4 | 4 | 1 | 65 | 229.307 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.05 | 5.48 | -6.83 | 3 | 4 | 0 | 64 | 228.299 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
