| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 4th, 2011 | 17 | Yes |
Popular Name: N-[(S)-(1-ethylimidazol-2-yl)-pyrimidin-4-yl-methyl]ethanamine N-[(S)-(1-ethylimidazol-2-yl)-py…
| 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) | 0.50 | 5 | -28.61 | 2 | 5 | 1 | 57 | 232.311 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.50 | 4.54 | -12.57 | 1 | 5 | 0 | 56 | 231.303 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.50 | 6.6 | -99.75 | 3 | 5 | 2 | 61 | 233.319 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
