| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 18th, 2011 | 21 | Yes |
Popular Name: 4-[(2R)-2-(aminomethyl)-5-fluoro-2,3-dihydrobenzofuran-7-yl]-6-methoxy-pyrimidin-2-amine 4-[(2R)-2-(aminomethyl)-5-fluoro…
| 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) | 0.80 | 2.35 | -51.98 | 5 | 6 | 1 | 98 | 291.306 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.80 | 1.97 | -8.05 | 4 | 6 | 0 | 96 | 290.298 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.80 | 3.27 | -94.93 | 6 | 6 | 2 | 99 | 292.314 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.80 | 2.68 | -97.85 | 6 | 6 | 2 | 99 | 292.314 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
