In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2004 | 17 | 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) | 2.07 | -0.68 | -41.89 | 2 | 3 | 1 | 33 | 233.335 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0767770A1; EP0830349A1; EP0830349B1; US5532356; US5637780; US5877312; WO1996000708A1 | IBM Patent Data |