In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 30th, 2008 | 27 | Yes |
Popular Name: 2-[4-[[(3S)-3-(methyl-phenethyl-amino)-1-piperidyl]methyl]phenoxy]ethanol 2-[4-[[(3S)-3-(methyl-phenethyl-…
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) | 3.39 | 8.49 | -41.51 | 2 | 4 | 1 | 37 | 369.529 | 9 | ↓ |
Lo Low (pH 4.5-6) | 3.39 | 10.78 | -121.73 | 3 | 4 | 2 | 38 | 370.537 | 9 | ↓ |
Lo Low (pH 4.5-6) | 3.39 | 8.57 | -43.75 | 2 | 4 | 1 | 37 | 369.529 | 9 | ↓ |