| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 21 | No |
Popular Name: N-[2-[[(3S)-1,1-dioxothian-3-yl]amino]ethyl]-4-methyl-benzamide N-[2-[[(3S)-1,1-dioxothian-3-yl]…
| 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) | 1.16 | 2.8 | -66.3 | 3 | 5 | 1 | 80 | 311.427 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.16 | 1.62 | -18.63 | 2 | 5 | 0 | 75 | 310.419 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![N-[2-[(1,1-diketothian-3-yl)amino]ethyl]benzamide](http://zinc12.docking.org/img/rings/287150.gif)