In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 3rd, 2010 | 20 | Yes |
Popular Name: (4-amino-1,2,5-oxadiazol-3-yl)-[4-(2-pyridyl)piperazin-1-yl]methanone (4-amino-1,2,5-oxadiazol-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) | 0.37 | 4.02 | -35.49 | 3 | 8 | 1 | 103 | 275.292 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.37 | 3.72 | -7.3 | 2 | 8 | 0 | 101 | 274.284 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.