In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 16 | Yes |
Popular Name: 2-[2-[[(1S,3S)-1-(hydroxymethyl)-3-methyl-cyclohexyl]amino]ethoxy]ethanol 2-[2-[[(1S,3S)-1-(hydroxymethyl)…
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) | 0.71 | -0.32 | -31.77 | 4 | 4 | 1 | 66 | 232.344 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.71 | -1.58 | -6.85 | 3 | 4 | 0 | 62 | 231.336 | 7 | ↓ |