| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 15 | Yes |
Popular Name: 6-ethyl-2-oxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile 6-ethyl-2-oxo-1,2,5,6,7,8-hexahy…
Find On: PubMed — Wikipedia — Google
CAS Number: 1249858-53-4
| 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) | 2.19 | 5.5 | -14.08 | 1 | 3 | 0 | 57 | 202.257 | 1 | ↓ |
| Hi High (pH 8-9.5) | 2.65 | 3.55 | -45.63 | 0 | 3 | -1 | 60 | 201.249 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 224 - 226 | Enamine Building Blocks |
| MP | 224...226 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
