In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 12th, 2011 | 22 | Yes |
Popular Name: 6-amino-1,4-dimethyl-7-(4-methylpiperazin-1-yl)quinoxaline-2,3-dione 6-amino-1,4-dimethyl-7-(4-methyl…
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) | 0.14 | 5.86 | -53.73 | 3 | 7 | 1 | 78 | 304.374 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.14 | 3.5 | -12.3 | 2 | 7 | 0 | 77 | 303.366 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.