In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 22nd, 2011 | 21 | Yes |
Popular Name: 3-fluoro-4-[(3-oxo-4-propyl-pyrazin-2-yl)amino]benzoic 3-fluoro-4-[(3-oxo-4-propyl-pyra…
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) | 2.74 | 8.12 | -53.31 | 1 | 6 | -1 | 87 | 290.274 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.74 | 7.97 | -53.93 | 2 | 6 | 0 | 88 | 291.282 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.