| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 7th, 2010 | 18 | Yes |
Popular Name: (4S)-6-fluoro-N-(1H-imidazol-5-ylmethyl)thiochroman-4-amine (4S)-6-fluoro-N-(1H-imidazol-5-y…
| 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) | 1.06 | 6.06 | -9.37 | 2 | 3 | 0 | 41 | 263.341 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.06 | 6.57 | -36.57 | 3 | 3 | 1 | 42 | 264.349 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.06 | 7.22 | -51.6 | 3 | 3 | 1 | 45 | 264.349 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
