In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2010 | 22 | Yes |
Popular Name: 4-[(1-thieno[3,2-d]pyrimidin-4-yl-4-piperidyl)methyl]morpholine 4-[(1-thieno[3,2-d]pyrimidin-4-y…
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) | 2.17 | 6.54 | -8.92 | 0 | 5 | 0 | 41 | 318.446 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.17 | 8.48 | -48.14 | 1 | 5 | 1 | 43 | 319.454 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.17 | 8.94 | -81.61 | 2 | 5 | 2 | 44 | 320.462 | 3 | ↓ |