In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2011 | 21 | Yes |
Popular Name: (2R)-3-[(2S,5R)-5-ethyl-2-methyl-morpholin-4-yl]-2-(methylamino)-2-phenyl-propan-1-ol (2R)-3-[(2S,5R)-5-ethyl-2-methyl…
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) | 2.22 | 3.53 | -38.95 | 3 | 4 | 1 | 49 | 293.431 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.22 | 2.45 | -4.05 | 2 | 4 | 0 | 45 | 292.423 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.22 | 4.93 | -113.76 | 4 | 4 | 2 | 51 | 294.439 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.22 | 3.91 | -32.12 | 3 | 4 | 1 | 46 | 293.431 | 6 | ↓ |