| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 25th, 2011 | 25 | Yes |
Popular Name: 2,5-dioxo-N-[(3S)-3-phenylbutyl]-1,6,7,8-tetrahydroquinoline-3-carboxamide 2,5-dioxo-N-[(3S)-3-phenylbutyl]…
| 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) | 2.87 | 7.28 | -20.08 | 2 | 5 | 0 | 79 | 338.407 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.33 | 6.62 | -55.68 | 1 | 5 | -1 | 82 | 337.399 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
