In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 17th, 2008 | 21 | No |
Popular Name: 5-nitro-2-[2-(2-methoxyphenyl)vinyl]-4,6-pyrimidinediol 5-nitro-2-[2-(2-methoxyphenyl)vi…
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) | 1.78 | 4.55 | -59.08 | 1 | 8 | -1 | 124 | 288.239 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.24 | 3.46 | -122.39 | 0 | 8 | -2 | 127 | 287.231 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.