In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 26th, 2005 | 34 | Yes |
None
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) | 3.40 | 0.16 | -125.16 | 1 | 10 | -2 | 140 | 460.494 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.40 | 0.31 | -99.94 | 2 | 10 | -1 | 141 | 461.502 | 9 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US5616599; US5646171 | IBM Patent Data |