| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2011 | 22 | Yes |
Popular Name: 3-[(2S,6S)-2,6-dimethylpiperidine-1-carbonyl]-1,6,7,8-tetrahydroquinoline-2,5-dione 3-[(2S,6S)-2,6-dimethylpiperidin…
| 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) | 1.34 | 6.16 | -19.33 | 1 | 5 | 0 | 70 | 302.374 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.80 | 5.16 | -57.03 | 0 | 5 | -1 | 73 | 301.366 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
