| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2009 | 21 | Yes |
Popular Name: 4-chloro-2-[[[(4S)-6-fluorothiochroman-4-yl]amino]methyl]phenol 4-chloro-2-[[[(4S)-6-fluorothioc…
| 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) | 3.43 | 7.42 | -47.26 | 3 | 2 | 1 | 37 | 324.828 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.43 | 6.99 | -41.62 | 1 | 2 | -1 | 35 | 322.812 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.43 | 6.24 | -4.68 | 2 | 2 | 0 | 32 | 323.82 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
