In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 16 | No |
Popular Name: (E)-7-[(3R)-3-hydroxy-5-oxo-cyclopenten-1-yl]hept-5-enoic (E)-7-[(3R)-3-hydroxy-5-oxo-cycl…
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) | 0.75 | 4.94 | -56.5 | 1 | 4 | -1 | 77 | 223.248 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.75 | 2.96 | -14.83 | 2 | 4 | 0 | 75 | 224.256 | 6 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US3952033; US4021452; US4039574; US4080458; US4087621; US4170597; US4172839; US4178456; US4197245; US4197407; US4202822; US4202988; US4209639; US4210651; US4212969; US4235797; US4243817; US4245121; US4254036; US4254285; US4297516; US4309441 | IBM Patent Data |
PUBCHEM_PATENT_ID | US4087621 | IBM Patent Data |