In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2011 | 21 | Yes |
Popular Name: 2-[1-[2-(3-fluoro-4-hydroxy-anilino)-2-oxo-ethyl]cyclopentyl]acetic 2-[1-[2-(3-fluoro-4-hydroxy-anil…
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) | 2.26 | 4.88 | -50.77 | 2 | 5 | -1 | 89 | 294.302 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.26 | 5.64 | -102.67 | 1 | 5 | -2 | 92 | 293.294 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.26 | 2.87 | -10.98 | 3 | 5 | 0 | 87 | 295.31 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.