In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2005 | 14 | No |
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) | 1.03 | 2.82 | -48.21 | 0 | 4 | -1 | 62 | 193.178 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP1021451A1; US5936127; WO1998030569A1 | IBM Patent Data |