In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 4th, 2010 | 10 | No |
Popular Name: 2-Pyridinecarbonitrile, 5-hydroxy-, 1-oxide (9CI) 2-Pyridinecarbonitrile, 5-hydrox…
Find On: PubMed — Wikipedia — Google
CAS Number: 727736-67-6
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) | -1.16 | 1.29 | -37.98 | 0 | 4 | -1 | 72 | 135.102 | 0 | ↓ |
Mid Mid (pH 6-8) | -1.16 | 0.52 | -23.95 | 1 | 4 | 0 | 69 | 136.11 | 0 | ↓ |