| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 21 | Yes |
Popular Name: (1R)-N-[2-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)ethyl]-1-(2-thienyl)ethanamine (1R)-N-[2-(1,3,4,5-tetrahydro-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) | 3.89 | 9.53 | -37.75 | 2 | 2 | 1 | 16 | 301.479 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.89 | 8.63 | -40.89 | 2 | 2 | 1 | 20 | 301.479 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.89 | 10.72 | -123.84 | 3 | 2 | 2 | 21 | 302.487 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
