| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2011 | 25 | Yes |
Popular Name: 4-[4-[(2S)-2-hydroxybutyl]piperazine-1-carbonyl]-1-methyl-quinolin-2-one 4-[4-[(2S)-2-hydroxybutyl]pipera…
| 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) | 1.00 | 3.85 | -12.69 | 1 | 6 | 0 | 66 | 343.427 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.00 | 6.12 | -50.14 | 2 | 6 | 1 | 67 | 344.435 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
