| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 17 | Yes |
Popular Name: (1S)-N-[(1R)-1-(3-bromo-2-thienyl)ethyl]-1-(4-pyridyl)ethanamine (1S)-N-[(1R)-1-(3-bromo-2-thieny…
| 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) | 3.36 | 7.33 | -38.78 | 2 | 2 | 1 | 29 | 312.256 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.36 | 6.18 | -4.63 | 1 | 2 | 0 | 25 | 311.248 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
