| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 23rd, 2011 | 28 | Yes |
Popular Name: MFCD17011964 MFCD17011964
Find On: PubMed — Wikipedia — Google
CAS Number: 1253789-93-3
Ethyl 5-hydroxy-8-isopentyl-7-oxo-2-phenyl-7,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylate
ethyl5-hydroxy-8-isopentyl-7-oxo-2-phenyl-7,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylate
ETHYLHYDROXYISOPENTYLOXOPHENYLDIHYDROPYRIDOPYRIMIDINECARBOXYLAT
| 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) | 3.98 | 12.41 | -46.75 | 0 | 7 | -1 | 97 | 380.424 | 7 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.
![8H-pyrido[2,3-d]pyrimidin-5-one](http://zinc12.docking.org/img/rings/7375.gif)
![2-phenyl-8H-pyrido[2,3-d]pyrimidin-5-one](http://zinc12.docking.org/img/rings/286828.gif)