In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 1st, 2009 | 16 | Yes |
Popular Name: 4-benzyl-2H-benzotriazole 4-benzyl-2H-benzotriazole
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) | 3.20 | 6.1 | -9.09 | 1 | 3 | 0 | 42 | 209.252 | 2 | ↓ |
Hi High (pH 8-9.5) | 3.20 | 6.2 | -43.42 | 0 | 3 | -1 | 40 | 208.244 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US4376635; US4536189 | IBM Patent Data |