| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 16 | No |
Popular Name: (2S)-2-(4-bromo-2-thienyl)-2-[(3R)-3-methylthiomorpholin-4-yl]ethanamine (2S)-2-(4-bromo-2-thienyl)-2-[(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) | 2.08 | 4.14 | -51.26 | 3 | 2 | 1 | 31 | 322.317 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.08 | 3.77 | -2.52 | 2 | 2 | 0 | 29 | 321.309 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
