In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 20 | Yes |
Popular Name: 2-[[[(4S)-6-fluorothiochroman-4-yl]amino]methyl]phenol 2-[[[(4S)-6-fluorothiochroman-4-…
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) | 2.77 | 6.97 | -45.94 | 3 | 2 | 1 | 37 | 290.383 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.77 | 6.12 | -5.12 | 2 | 2 | 0 | 32 | 289.375 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.