| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 5th, 2010 | 15 | No |
Popular Name: [1,1-Biphenyl]-3-carboxaldehyde, 6-hydroxy- (9CI) [1,1-Biphenyl]-3-carboxaldehyde,…
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CAS Number: 21363-10-0
| 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) | 3.23 | 5.22 | -8.06 | 1 | 2 | 0 | 37 | 198.221 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.23 | 5.93 | -44.14 | 0 | 2 | -1 | 40 | 197.213 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0450932A3; US4279803; US4299756; US4429100; US4473682; US4522974; US5015722 | IBM Patent Data |
