In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2008 | 23 | Yes |
Popular Name: 3-[(4,6-dimethylpyrimidin-2-yl)amino]-N-methyl-N-[2-(1-piperidyl)ethyl]propanamide 3-[(4,6-dimethylpyrimidin-2-yl)a…
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) | 1.83 | 9.59 | -44.25 | 2 | 6 | 1 | 63 | 320.461 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.83 | 7.31 | -14.88 | 1 | 6 | 0 | 61 | 319.453 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.83 | 10.05 | -80.74 | 3 | 6 | 2 | 64 | 321.469 | 7 | ↓ |