In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 24th, 2009 | 14 | 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) | 3.96 | 6.23 | -3.96 | 1 | 1 | 0 | 20 | 212.72 | 6 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0247381A2; EP0247381B1; EP0393607A2; EP0393607B1; EP0632031A1; EP0632031B1; EP1000620A1; US5047521; US5145865; US5496853; US6166036 | IBM Patent Data |