In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 19th, 2008 | 30 | Yes |
Popular Name: 6-methyl-2-[(methyl-oxo-BLAHyl)sulfanylmethyl]-4-oxo-3H-furo[5,4-d]pyrimidine-5-carboxylic 6-methyl-2-[(methyl-oxo-BLAHyl)s…
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) | 1.97 | 8.45 | -65.92 | 1 | 9 | -1 | 134 | 443.486 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.43 | 5.98 | -126.97 | 0 | 9 | -2 | 137 | 442.478 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.