| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 21 | Yes |
Popular Name: (2S)-2-(4,5-dibromo-2-furyl)-2-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)ethanamine (2S)-2-(4,5-dibromo-2-furyl)-2-(…
| 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) | 3.56 | 6.85 | -49.95 | 3 | 3 | 1 | 44 | 415.149 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.56 | 8.04 | -33.08 | 3 | 3 | 1 | 44 | 415.149 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.56 | 8.49 | -133.83 | 4 | 3 | 2 | 45 | 416.157 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
