In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 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) | 0.26 | 4.29 | -44.57 | 1 | 4 | -1 | 69 | 200.258 | 6 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0549352A2; EP0549352A3; EP0549352B1 | IBM Patent Data |
PUBCHEM_PATENT_ID | EP0994881A1; WO1999001459A1 | IBM Patent Data |