In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 21 | Yes |
Popular Name: 1-[4-(2-methyl-6-pyrrolidin-1-yl-pyrimidin-4-yl)piperazin-1-yl]ethanone 1-[4-(2-methyl-6-pyrrolidin-1-yl…
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) | 0.42 | 7.78 | -13.9 | 0 | 6 | 0 | 53 | 289.383 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.42 | 8.22 | -33.48 | 1 | 6 | 1 | 54 | 290.391 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.42 | 8.06 | -34.93 | 1 | 6 | 1 | 54 | 290.391 | 2 | ↓ |