In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2008 | 20 | Yes |
Popular Name: (4S)-N-[(1R)-1-(3-fluorophenyl)ethyl]thiochroman-4-amine (4S)-N-[(1R)-1-(3-fluorophenyl)e…
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) | 3.39 | 10.22 | -47.73 | 2 | 1 | 1 | 17 | 288.411 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.39 | 9.3 | -6.21 | 1 | 1 | 0 | 12 | 287.403 | 3 | ↓ |