In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 21 | Yes |
Popular Name: 6-[[(1R)-1-(2-pyridyl)ethyl]amino]-1,4-dihydroquinoxaline-2,3-dione 6-[[(1R)-1-(2-pyridyl)ethyl]amin…
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) | 0.36 | 3.25 | -13.85 | 3 | 6 | 0 | 91 | 282.303 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.36 | 3.42 | -49.19 | 4 | 6 | 1 | 92 | 283.311 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.