| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 18th, 2011 | 21 | Yes |
Popular Name: 2-[(2S)-2-(aminomethyl)-5-chloro-2,3-dihydrobenzofuran-7-yl]-N,6-dimethyl-pyrimidin-4-amine 2-[(2S)-2-(aminomethyl)-5-chloro…
| 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) | 1.97 | 4.88 | -52.25 | 4 | 5 | 1 | 75 | 305.789 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.97 | 4.46 | -10.54 | 3 | 5 | 0 | 73 | 304.781 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.97 | 5.2 | -88.45 | 5 | 5 | 2 | 76 | 306.797 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
