In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 20 | Yes |
Popular Name: (2R)-1-[(1S)-1,3-dimethylbutoxy]-3-[[(1S)-1-(4-pyridyl)ethyl]amino]propan-2-ol (2R)-1-[(1S)-1,3-dimethylbutoxy]…
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) | 2.12 | 4.72 | -46.34 | 3 | 4 | 1 | 59 | 281.42 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.12 | 3.62 | -6.77 | 2 | 4 | 0 | 54 | 280.412 | 9 | ↓ |