In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 6th, 2011 | 18 | No |
Popular Name: N-(5-chloro-2-hydroxy-phenyl)-1-oxido-pyridin-1-ium-3-carboxamide N-(5-chloro-2-hydroxy-phenyl)-1-…
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) | 0.73 | 2.89 | -19.08 | 2 | 5 | 0 | 75 | 264.668 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.73 | 3.65 | -50.55 | 1 | 5 | -1 | 78 | 263.66 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.