| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 20th, 2008 | 23 | No |
Popular Name: [4-(2-hydroxy-5-nitro-phenyl)-1,2,5-thiadiazol-3-yl]-(1-piperidyl)methanone [4-(2-hydroxy-5-nitro-phenyl)-1,…
| 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) | 2.46 | 4.65 | -40.69 | 0 | 8 | -1 | 115 | 333.349 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.46 | 4.26 | -10.77 | 1 | 8 | 0 | 112 | 334.357 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
