In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: (1S,2S)-2-(3,3-dimethylmorpholin-4-yl)-1-phenyl-propan-1-amine (1S,2S)-2-(3,3-dimethylmorpholin…
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) | 0.44 | 3.51 | -43.06 | 3 | 3 | 1 | 40 | 249.378 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.44 | 3.1 | -2.44 | 2 | 3 | 0 | 38 | 248.37 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.44 | 5.19 | -123.61 | 4 | 3 | 2 | 41 | 250.386 | 3 | ↓ |