In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2010 | 21 | No |
Popular Name: (2S)-2-amino-3-(3,4-dihydroxyphenyl)-1-(3,3-dimethylmorpholin-4-yl)propan-1-one (2S)-2-amino-3-(3,4-dihydroxyphe…
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) | 0.02 | -0.66 | -50.93 | 5 | 6 | 1 | 98 | 295.359 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.02 | -1 | -12.02 | 4 | 6 | 0 | 96 | 294.351 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.