In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 23 | Yes |
Popular Name: N-(4-pyridylmethyl)-4-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]butanamide N-(4-pyridylmethyl)-4-[3-(2-thie…
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) | 1.77 | 4.59 | -18.11 | 1 | 6 | 0 | 81 | 328.397 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.77 | 5.05 | -51.01 | 2 | 6 | 1 | 82 | 329.405 | 7 | ↓ |