In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 32 | Yes |
Popular Name: 3,4-dimethoxy-N-[4-[(2-methyl-6-pyrrolidin-1-yl-pyrimidin-4-yl)amino]phenyl]benzamide 3,4-dimethoxy-N-[4-[(2-methyl-6-…
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) | 3.60 | 8.98 | -43.27 | 3 | 8 | 1 | 90 | 434.52 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.60 | 8.73 | -38.33 | 3 | 8 | 1 | 90 | 434.52 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.60 | 8.54 | -18.71 | 2 | 8 | 0 | 89 | 433.512 | 7 | ↓ |