In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 31 | Yes |
Popular Name: [1-(4-anilinopyrimidin-2-yl)-4-piperidyl]-(1,4-dioxa-8-azaspiro[4.5]decan-8-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) | 3.49 | 11.99 | -14.95 | 1 | 8 | 0 | 80 | 423.517 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.49 | 12.3 | -40.39 | 2 | 8 | 1 | 81 | 424.525 | 4 | ↓ |