In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 25th, 2006 | 8 | 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) | -0.60 | -5.2 | -7.22 | 2 | 3 | 0 | 49 | 118.132 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0362967A1; EP0362967B1; EP0366171A1; EP0366171B1; EP0437469A1; EP0437527A1; EP0693077A1; EP0693077B1; US4892865; US5051498; US5220003; US6153594; WO1994022887A1 | IBM Patent Data |