In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2009 | 21 | Yes |
Popular Name: 7-(5-bromo-2-fluoro-phenyl)-2,5,6-trimethyl-pyrrolo[2,3-d]pyrimidin-4-amine 7-(5-bromo-2-fluoro-phenyl)-2,5,…
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) | 3.51 | 9.35 | -11.15 | 2 | 4 | 0 | 57 | 349.207 | 1 | ↓ |
Mid Mid (pH 6-8) | 3.51 | 9.77 | -23.8 | 3 | 4 | 1 | 58 | 350.215 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.