In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 3rd, 2010 | 14 | Yes |
Popular Name: (4-amino-1,2,5-oxadiazol-3-yl)-piperazin-1-yl-methanone (4-amino-1,2,5-oxadiazol-3-yl)-p…
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) | -1.02 | -0.25 | -48.57 | 4 | 7 | 1 | 102 | 198.206 | 1 | ↓ |
Mid Mid (pH 6-8) | -1.02 | -1.53 | -5.6 | 3 | 7 | 0 | 97 | 197.198 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.