In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 11th, 2008 | 13 | Yes |
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) | 1.04 | 3.68 | -49.32 | 1 | 3 | -1 | 60 | 179.195 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0434469A2; EP0434469B1; EP0473206A2; EP0473206A3; EP0473206B1; US4603171; US5115035; US5332784 | IBM Patent Data |