In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 32 | Yes |
Popular Name: 4-tert-butyl-N-[4-[(2-methyl-6-pyrrolidin-1-yl-pyrimidin-4-yl)amino]phenyl]benzamide 4-tert-butyl-N-[4-[(2-methyl-6-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) | 5.66 | 12.05 | -38.59 | 3 | 6 | 1 | 71 | 430.576 | 6 | ↓ |
Mid Mid (pH 6-8) | 5.66 | 11.8 | -33.76 | 3 | 6 | 1 | 71 | 430.576 | 6 | ↓ |
Mid Mid (pH 6-8) | 5.66 | 11.61 | -14.57 | 2 | 6 | 0 | 70 | 429.568 | 6 | ↓ |