In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 13th, 2010 | 9 | 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) | -1.64 | 2.01 | -34.2 | 3 | 3 | 0 | 68 | 129.159 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0244195A1; EP0268343A2; EP0268343B1; US4666835 | IBM Patent Data |