| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 19 | No |
Popular Name: (2S)-1-[[(3R)-1,1-dioxothian-3-yl]amino]-3-(1,2,5-thiadiazol-3-yloxy)propan-2-ol (2S)-1-[[(3R)-1,1-dioxothian-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) | -0.36 | -4.31 | -61.48 | 3 | 7 | 1 | 106 | 308.405 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.36 | -5.55 | -13.96 | 2 | 7 | 0 | 101 | 307.397 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![(1,1-diketothian-3-yl)-[3-(1,2,5-thiadiazol-3-yloxy)propyl]amine](http://zinc12.docking.org/img/rings/290115.gif)