In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 1st, 2009 | 13 | Yes |
Popular Name: 5-(hydroxymethyl)-2-methyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one 5-(hydroxymethyl)-2-methyl-1H-[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) | -0.37 | 0.32 | -48.83 | 1 | 6 | -1 | 86 | 179.159 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US4956462; US4958019; US4987129 | IBM Patent Data |