In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2011 | 25 | Yes |
Popular Name: 4-[(2R)-2-[3-(4-methylpyrazol-1-yl)azetidin-1-yl]propanoyl]-1,3-dihydroquinoxalin-2-one 4-[(2R)-2-[3-(4-methylpyrazol-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) | 1.38 | 6.6 | -49.82 | 2 | 7 | 1 | 72 | 340.407 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.38 | 3.74 | -14.16 | 1 | 7 | 0 | 70 | 339.399 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.