In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 29 | Yes |
Popular Name: 3-[[4-[ethyl(1H-indazol-4-yl)amino]-5-fluoro-pyrimidin-2-yl]amino]benzamide 3-[[4-[ethyl(1H-indazol-4-yl)ami…
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) | 3.37 | 8.19 | -14.29 | 4 | 8 | 0 | 113 | 391.41 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.37 | 8.62 | -40.14 | 5 | 8 | 1 | 114 | 392.418 | 6 | ↓ |