| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 21 | Yes |
Popular Name: 3-[5-(1,3,4,5-tetrahydro-2-benzazepin-2-ylmethyl)-3-thienyl]prop-2-yn-1-ol 3-[5-(1,3,4,5-tetrahydro-2-benza…
| 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) | 3.04 | 8.82 | -41.47 | 2 | 2 | 1 | 25 | 298.431 | 2 | ↓ |
| Mid Mid (pH 6-8) | 3.04 | 6.75 | -8.23 | 1 | 2 | 0 | 23 | 297.423 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
