In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 19 | No |
Popular Name: (1S)-1-[4-(aminomethyl)phenyl]-2-(1,1-dioxo-1,4-thiazinan-4-yl)ethanol (1S)-1-[4-(aminomethyl)phenyl]-2…
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) | -0.40 | 0.17 | -110.07 | 5 | 5 | 2 | 86 | 286.397 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.40 | -2.33 | -12.84 | 3 | 5 | 0 | 84 | 284.381 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.40 | -1.93 | -55.48 | 4 | 5 | 1 | 85 | 285.389 | 4 | ↓ |