In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 21 | Yes |
Popular Name: 4-[(2R)-2-amino-2-[3-(2-pyridyl)-1,2,4-oxadiazol-5-yl]ethyl]phenol 4-[(2R)-2-amino-2-[3-(2-pyridyl)…
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) | -0.28 | 0.85 | -56.3 | 4 | 6 | 1 | 100 | 283.311 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.28 | 0.52 | -14.12 | 3 | 6 | 0 | 98 | 282.303 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.28 | 1.42 | -102.07 | 5 | 6 | 2 | 101 | 284.319 | 4 | ↓ |