| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 16 | Yes |
Popular Name: 2-oxo-6-propyl-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile 2-oxo-6-propyl-1,2,5,6,7,8-hexah…
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CAS Number: 1248123-19-4
| 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) | 2.75 | 6.25 | -14.2 | 1 | 3 | 0 | 57 | 216.284 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.21 | 4.31 | -45.6 | 0 | 3 | -1 | 60 | 215.276 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 233 - 235 | Enamine Building Blocks |
| MP | 233...235 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
