In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 25 | Yes |
Popular Name: 2-[4-[4-(2-piperazin-1-ylethyl)piperazin-1-yl]phenoxy]acetic 2-[4-[4-(2-piperazin-1-ylethyl)p…
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) | 0.56 | 6.7 | -127.86 | 3 | 7 | 1 | 77 | 349.455 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.56 | 4.49 | -78.15 | 2 | 7 | 0 | 76 | 348.447 | 7 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US5994356 | IBM Patent Data |