| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 4th, 2010 | 10 | No |
Popular Name: 4,5-Pyridazinediol, hexahydro-3-(hydroxymethyl)-, (3R,4R,5S)- (9CI) 4,5-Pyridazinediol, hexahydro-3-…
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CAS Number: 296784-05-9
| 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) | -2.22 | -8.43 | -7.09 | 5 | 5 | 0 | 85 | 148.162 | 1 | ↓ |
| Lo Low (pH 4.5-6) | -2.22 | -7.83 | -38.82 | 6 | 5 | 1 | 89 | 149.17 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | WO1997031901A1 | IBM Patent Data |
