| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 21 | Yes |
Popular Name: 2-bromo-4-[[[(1S)-indan-1-yl]amino]methyl]-6-methoxy-phenol 2-bromo-4-[[[(1S)-indan-1-yl]ami…
| 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) | 3.65 | 7.11 | -50.73 | 3 | 3 | 1 | 46 | 349.248 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.65 | 5.83 | -7.95 | 2 | 3 | 0 | 41 | 348.24 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.65 | 6.59 | -46.61 | 1 | 3 | -1 | 44 | 347.232 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.65 | 7.87 | -62.91 | 2 | 3 | 0 | 49 | 348.24 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
