In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 21 | Yes |
Popular Name: 4-[(2S)-2-hydroxy-3-[[(2S)-2-hydroxy-3-methoxy-propyl]-methyl-amino]propoxy]benzonitrile 4-[(2S)-2-hydroxy-3-[[(2S)-2-hyd…
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) | 0.47 | 1.75 | -49.87 | 3 | 6 | 1 | 87 | 295.359 | 9 | ↓ |