In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2004 | 17 | 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) | 3.67 | 1.56 | -8.44 | 1 | 3 | 0 | 46 | 228.247 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0221346A1; EP0221346B1; EP0778821A1; EP0778821B1; EP1028941A2; US4116961; US4939133; US5965741; WO1996006822A1; WO1999024394A2; WO2000055153A1 | IBM Patent Data |