In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 28th, 2011 | 23 | Yes |
Popular Name: 3-[(2S)-2-isopropyl-3-oxo-piperazine-1-carbonyl]-1H-quinolin-4-one 3-[(2S)-2-isopropyl-3-oxo-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) | -0.32 | 4.7 | -28.93 | 2 | 6 | 0 | 82 | 313.357 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.