| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 17th, 2005 | 27 | No |
Popular Name: ethyl 4-(4-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate ethyl 4-(4-methoxyphenyl)-2,7,7-…
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CAS Number: 181480-21-7
| 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) | 4.51 | 1.38 | -7.94 | 0 | 5 | 0 | 64 | 369.461 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.51 | 1.36 | -11.21 | 0 | 5 | 0 | 64 | 369.461 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.70 | 0.48 | -9.35 | 0 | 5 | 0 | 64 | 369.461 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 253 - 255 | KeyOrganics |
