In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 23 | Yes |
Popular Name: 1-[4-(2-methyl-6-pyrrolidin-1-yl-pyrimidin-4-yl)piperazin-1-yl]butan-1-one 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) | 1.82 | 7.09 | -11.97 | 0 | 6 | 0 | 53 | 317.437 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.82 | 7.27 | -36.18 | 1 | 6 | 1 | 54 | 318.445 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.82 | 7.35 | -36.18 | 1 | 6 | 1 | 54 | 318.445 | 4 | ↓ |