In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 30 | Yes |
Popular Name: 3,4-dimethyl-N-[4-[(2-methyl-6-pyrrolidin-1-yl-pyrimidin-4-yl)amino]phenyl]benzamide 3,4-dimethyl-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) | 4.78 | 11.05 | -39.13 | 3 | 6 | 1 | 71 | 402.522 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.78 | 10.81 | -34.24 | 3 | 6 | 1 | 71 | 402.522 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.78 | 10.61 | -15.34 | 2 | 6 | 0 | 70 | 401.514 | 5 | ↓ |