In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2010 | 20 | Yes |
Popular Name: 2-(3,5-diiodo-4-oxo-1-pyridyl)-N-(4-pyridylmethyl)acetamide 2-(3,5-diiodo-4-oxo-1-pyridyl)-N…
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) | 1.71 | 6.65 | -22.78 | 1 | 5 | 0 | 64 | 495.058 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.71 | 7.1 | -60.15 | 2 | 5 | 1 | 65 | 496.066 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.