| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2009 | 20 | Yes |
Popular Name: (4S)-N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-6-fluoro-thiochroman-4-amine (4S)-N-[(3,5-dimethyl-1H-pyrazol…
| 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) | 1.59 | 7.2 | -49.25 | 3 | 3 | 1 | 45 | 292.403 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.59 | 6.37 | -8.2 | 2 | 3 | 0 | 41 | 291.395 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
