In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 30th, 2010 | 13 | Yes |
Popular Name: 1-benzyl-3-methyl-pyrazole 1-benzyl-3-methyl-pyrazole
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) | 2.20 | 6.73 | -6.96 | 0 | 2 | 0 | 18 | 172.231 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP1021413A1 | IBM Patent Data |