In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 18th, 2008 | 20 | No |
Popular Name: [2-methoxy-4-[(Z)-(2-methyl-5-oxo-oxazol-4-ylidene)methyl]phenyl] [2-methoxy-4-[(Z)-(2-methyl-5-ox…
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) | 0.76 | 6.63 | -14.39 | 0 | 6 | 0 | 79 | 275.26 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.76 | 5 | -14.07 | 0 | 6 | 0 | 79 | 275.26 | 4 | ↓ |
Note Type | Comments | Provided By |
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PUBCHEM_PATENT_ID | US4005127; US4014920; US4038414 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.