In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 6th, 2006 | 28 | 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) | 7.64 | 12.7 | -6.83 | 0 | 4 | 0 | 43 | 366.42 | 6 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0178185A2; EP0178185B1; US4868271; US5436310 | IBM Patent Data |