In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 31 | Yes |
Popular Name: 3,4-dimethyl-N-[4-[(2-methyl-6-morpholino-pyrimidin-4-yl)amino]phenyl]benzamide 3,4-dimethyl-N-[4-[(2-methyl-6-m…
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) | 4.22 | 9.36 | -41.8 | 3 | 7 | 1 | 81 | 418.521 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.22 | 9.2 | -37.4 | 3 | 7 | 1 | 81 | 418.521 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.22 | 8.93 | -16.6 | 2 | 7 | 0 | 79 | 417.513 | 5 | ↓ |