| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 18 | Yes |
Popular Name: (4S)-6-chloro-N-(1H-pyrazol-3-ylmethyl)thiochroman-4-amine (4S)-6-chloro-N-(1H-pyrazol-3-yl…
| 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) | 1.97 | 6.54 | -42.66 | 3 | 3 | 1 | 45 | 280.804 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.97 | 5.35 | -5.83 | 2 | 3 | 0 | 41 | 279.796 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
