In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2010 | 20 | Yes |
Popular Name: (4R)-8-fluoro-N-[(1-methyl-4-piperidyl)methyl]thiochroman-4-amine (4R)-8-fluoro-N-[(1-methyl-4-pip…
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) | 2.21 | 9.83 | -113.64 | 3 | 2 | 2 | 21 | 296.455 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.21 | 8.77 | -39.09 | 2 | 2 | 1 | 16 | 295.447 | 3 | ↓ |