In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 17 | No |
Popular Name: [(1R,2S)-2-(1,1-dioxo-1,4-thiazinan-4-yl)cycloheptyl]methanamine [(1R,2S)-2-(1,1-dioxo-1,4-thiazi…
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) | 0.69 | 0.46 | -60.04 | 3 | 4 | 1 | 65 | 261.411 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.69 | 1.86 | -139.49 | 4 | 4 | 2 | 66 | 262.419 | 2 | ↓ |