In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 12th, 2009 | 18 | Yes |
Popular Name: (1S)-3-[(2S,5R)-2,5-dimethylmorpholin-4-yl]-1-phenyl-propan-1-amine (1S)-3-[(2S,5R)-2,5-dimethylmorp…
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) | 0.27 | 3.56 | -3.75 | 2 | 3 | 0 | 38 | 248.37 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.27 | 6.09 | -121.08 | 4 | 3 | 2 | 41 | 250.386 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.27 | 5.75 | -36.59 | 3 | 3 | 1 | 40 | 249.378 | 4 | ↓ |