| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2010 | 18 | No |
Popular Name: 3-[3-(4-pyridylmethyl)-1,2,4-oxadiazol-5-yl]thiophen-2-amine 3-[3-(4-pyridylmethyl)-1,2,4-oxa…
| 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) | 1.00 | 3.54 | -13.57 | 1 | 5 | 0 | 76 | 258.306 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.58 | 2.6 | -9.55 | 2 | 5 | 0 | 78 | 258.306 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.00 | 3.51 | -38.8 | 2 | 5 | 1 | 77 | 259.314 | 3 | ↓ |
