| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 29th, 2009 | 20 | Yes |
Popular Name: (4S)-8-fluoro-N-[2-(3-pyridyl)ethyl]thiochroman-4-amine (4S)-8-fluoro-N-[2-(3-pyridyl)et…
| 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) | 1.98 | 7.49 | -8.76 | 1 | 2 | 0 | 25 | 288.391 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.98 | 9.14 | -117.01 | 3 | 2 | 2 | 31 | 290.407 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.98 | 8.67 | -57.52 | 2 | 2 | 1 | 29 | 289.399 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
