| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 20 | Yes |
Popular Name: (2S)-2-(5-bromo-2-furyl)-2-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)ethanamine (2S)-2-(5-bromo-2-furyl)-2-(1,3,…
| 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) | 2.83 | 6.09 | -47.88 | 3 | 3 | 1 | 44 | 336.253 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.83 | 7.4 | -30.77 | 3 | 3 | 1 | 44 | 336.253 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.83 | 7.84 | -129.09 | 4 | 3 | 2 | 45 | 337.261 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
