In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 21 | No |
Popular Name: (2S)-1-[2-(aminomethyl)phenoxy]-3-(1,1-dioxo-1,4-thiazinan-4-yl)propan-2-ol (2S)-1-[2-(aminomethyl)phenoxy]-…
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) | -0.22 | -0.14 | -117.78 | 5 | 6 | 2 | 96 | 316.423 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.22 | -2.67 | -14.82 | 3 | 6 | 0 | 93 | 314.407 | 6 | ↓ |
Mid Mid (pH 6-8) | -0.22 | -2.27 | -52.12 | 4 | 6 | 1 | 94 | 315.415 | 6 | ↓ |