| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 20 | Yes |
Popular Name: 1-(1-methylpyrrol-2-yl)-2-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)ethanone 1-(1-methylpyrrol-2-yl)-2-(1,3,4…
| 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) | 2.62 | 10.49 | -39.03 | 1 | 3 | 1 | 26 | 269.368 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.62 | 8.47 | -8.09 | 0 | 3 | 0 | 25 | 268.36 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
