In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 17 | Yes |
Popular Name: 2-[5-amino-3-(4-bromo-2-fluoro-phenyl)pyrazol-1-yl]ethanol 2-[5-amino-3-(4-bromo-2-fluoro-p…
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) | 1.94 | 2.74 | -7.06 | 3 | 4 | 0 | 64 | 300.131 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.94 | 3 | -29.04 | 4 | 4 | 1 | 65 | 301.139 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.