In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2009 | 18 | Yes |
Popular Name: 4-ethyl-2-[5-[(1R,2S)-2-methylcyclopropyl]-2-furyl]-1H-pyrimidin-6-one 4-ethyl-2-[5-[(1R,2S)-2-methylcy…
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) | 2.93 | 6.69 | -9.48 | 1 | 4 | 0 | 59 | 244.294 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.38 | 4.74 | -54.18 | 0 | 4 | -1 | 62 | 243.286 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.