In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2004 | 14 | 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) | 2.33 | 2.96 | -5.24 | 0 | 3 | 0 | 35 | 194.23 | 6 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0324431A1; EP0324431B1; US4935432; US5017703 | IBM Patent Data |