In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2009 | 20 | Yes |
Popular Name: methoxyBLAHol methoxyBLAHol
None
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) | 2.75 | 3.82 | -44.6 | 3 | 3 | 1 | 46 | 274.384 | 1 | ↓ |
Hi High (pH 8-9.5) | 2.75 | 2.53 | -4.48 | 2 | 3 | 0 | 41 | 273.376 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US3980641; US4017497; US4052389; US5504208 | IBM Patent Data |