In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 7th, 2005 | 18 | 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) | 3.13 | 6.97 | -40.76 | 4 | 2 | 1 | 43 | 243.374 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0749313A1; US5688807; US5705519; US5736544; WO1995024200A1 | IBM Patent Data |