| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 24th, 2010 | 15 | No |
Popular Name: 3-(2-amino-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl)-1,4-dihydro-1,2,4-triazol-5-one 3-(2-amino-5,6-dihydro-4H-cyclop…
| 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) | 0.27 | 2.02 | -12.18 | 3 | 5 | 0 | 85 | 222.273 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.00 | 1.21 | -8.18 | 4 | 5 | 0 | 88 | 222.273 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.73 | 0.1 | -10.91 | 2 | 5 | 0 | 88 | 221.265 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![4,5,6,6a-tetrahydrocyclopenta[b]thiophen-2-ylideneamine](http://zinc12.docking.org/img/rings/21684.gif)
![3-(2-imino-4,5,6,6a-tetrahydrocyclopenta[b]thiophen-3-yl)-1,4-dihydro-1,2,4-triazol-5-one](http://zinc12.docking.org/img/rings/608303.gif)