In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 29 | Yes |
Popular Name: [1-(4-anilinopyrimidin-2-yl)-4-piperidyl]-(azocan-1-yl)methanone [1-(4-anilinopyrimidin-2-yl)-4-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) | 5.13 | 14.71 | -13.45 | 1 | 6 | 0 | 61 | 393.535 | 4 | ↓ |
Lo Low (pH 4.5-6) | 5.13 | 15.07 | -37.18 | 2 | 6 | 1 | 63 | 394.543 | 4 | ↓ |