In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 17th, 2011 | 30 | No |
Popular Name: 4-hydroxy-3,5-dimethoxy-N-[(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methyl]benzamide 4-hydroxy-3,5-dimethoxy-N-[(7-ni…
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) | -0.46 | 1.43 | -20.8 | 4 | 12 | 0 | 179 | 416.346 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.45 | -0.74 | -45.9 | 3 | 12 | -1 | 182 | 415.338 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.45 | -0.55 | -43.75 | 3 | 12 | -1 | 182 | 415.338 | 6 | ↓ |