In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 15 | Yes |
Popular Name: (2S)-2-amino-2-[3-(2-pyridyl)-1,2,4-oxadiazol-5-yl]ethanol (2S)-2-amino-2-[3-(2-pyridyl)-1,…
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) | -2.24 | -3.38 | -50.29 | 4 | 6 | 1 | 100 | 207.213 | 3 | ↓ |
Mid Mid (pH 6-8) | -2.24 | -3.7 | -11.66 | 3 | 6 | 0 | 98 | 206.205 | 3 | ↓ |
Lo Low (pH 4.5-6) | -2.24 | -2.81 | -92.65 | 5 | 6 | 2 | 101 | 208.221 | 3 | ↓ |