In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 11th, 2008 | 14 | Yes |
Popular Name: 5-tert-butyl-4H-[1,2,4]triazolo[5,1-b]pyrimidin-7-one 5-tert-butyl-4H-[1,2,4]triazolo[…
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) | 1.91 | 5.55 | -43.65 | 0 | 5 | -1 | 66 | 191.214 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US4551419; US4604339; US5221604; US5374513; US5500336 | IBM Patent Data |