In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 4th, 2010 | 12 | 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) | 3.17 | 6.58 | -41.21 | 0 | 2 | -1 | 40 | 204.032 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0609798A1; EP0625505A2; EP0625505A3; EP0625505B1; US4218464; US5330994; US5374606; US5886218 | IBM Patent Data |