| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 26th, 2011 | 48 | No |
Popular Name: (Z)-allyl-[(Z)-[allyl(dihydroxy)BLAHylidene]hydrazono]BLAHdiol (Z)-allyl-[(Z)-[allyl(dihydroxy)…
| 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) | 3.44 | 5.88 | -101.16 | 6 | 10 | 2 | 133 | 652.792 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.44 | 1.58 | -19.99 | 4 | 10 | 0 | 131 | 650.776 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.44 | 3.72 | -58.48 | 5 | 10 | 1 | 132 | 651.784 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0077521A1; EP0238507A1; EP0527975A1; EP0527975B1; EP0612845A3; EP0632041A1; EP0760661A1; EP0760661B1; EP0782445A1; EP0832151A2; EP0871488A1; EP0941079A1; EP1005336A1; US4608376; US4760069; US4803208; US4889860; US5270220; US5317022; US5457110; US5603955 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.
