| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2010 | 21 | No |
Popular Name: 1-[2-[[(3R)-1,1-dioxothiolan-3-yl]amino]ethyl]quinolin-4-one 1-[2-[[(3R)-1,1-dioxothiolan-3-y…
| 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) | -0.08 | 4.5 | -95.25 | 2 | 5 | 1 | 73 | 307.395 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.08 | 3.32 | -25.79 | 1 | 5 | 0 | 68 | 306.387 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1-[2-[(1,1-diketothiolan-3-yl)amino]ethyl]-4-quinolone](http://zinc12.docking.org/img/rings/77121.gif)