In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2009 | 21 | Yes |
Popular Name: (2S)-2-(2,5-dimethylphenyl)-1-(2-morpholinoethylamino)propan-2-ol (2S)-2-(2,5-dimethylphenyl)-1-(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) | 1.84 | 3.13 | -51.42 | 3 | 4 | 1 | 49 | 293.431 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.84 | 2 | -6.89 | 2 | 4 | 0 | 45 | 292.423 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.84 | 4.32 | -42.98 | 3 | 4 | 1 | 46 | 293.431 | 6 | ↓ |