| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 8th, 2010 | 19 | Yes |
Popular Name: (4S)-6-fluoro-N-[(1-methyltriazol-4-yl)methyl]thiochroman-4-amine (4S)-6-fluoro-N-[(1-methyltriazo…
| 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) | 0.99 | 6.2 | -50.16 | 2 | 4 | 1 | 47 | 279.364 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.99 | 5.37 | -13.32 | 1 | 4 | 0 | 43 | 278.356 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
