In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 9th, 2008 | 17 | No |
Popular Name: (6S)-5-acetyl-4-methyl-6-(3-pyridyl)-3,6-dihydro-1H-pyrimidin-2-one (6S)-5-acetyl-4-methyl-6-(3-pyri…
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) | 0.44 | 2.7 | -13.32 | 2 | 5 | 0 | 71 | 231.255 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.44 | 2.98 | -37.89 | 3 | 5 | 1 | 72 | 232.263 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.