In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 32 | Yes |
Popular Name: N-[4-[[2-methyl-6-(1-piperidyl)pyrimidin-4-yl]amino]phenyl]-1,3-benzodioxole-5-carboxamide N-[4-[[2-methyl-6-(1-piperidyl)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) | 4.35 | 9.81 | -37.29 | 3 | 8 | 1 | 90 | 432.504 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.35 | 9.98 | -41.03 | 3 | 8 | 1 | 90 | 432.504 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.35 | 9.71 | -20.08 | 2 | 8 | 0 | 89 | 431.496 | 5 | ↓ |