In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 26th, 2011 | 16 | Yes |
Popular Name: 2-[(2R)-7-methyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl]acetic 2-[(2R)-7-methyl-3-oxo-2,4-dihyd…
None
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) | 1.38 | 3.33 | -44.75 | 2 | 5 | -1 | 81 | 219.22 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.38 | 1.34 | -7.59 | 3 | 5 | 0 | 78 | 220.228 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.