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Documentation4-hydroxybenzyl Alcohol
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM00824 |
| SMILES |
OCc1ccc(O)cc1
|
| InChIKey |
BVJSUAQZOZWCKN-UHFFFAOYSA-N
|
| MW [Da] |
124.14
Automatically obtained from RDkit software. |
| LogP |
0.88
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
125
|
|
DrugBank |
N/A |
|
ChEBI |
CHEBI:67410
|
|
PDB |
N/A |
|
ChEMBL |
CHEMBL202132
|
Similar entries
MM454624
Similarity: 0.7778
Similarity to MM454624
| Tanimoto metric | 0.7778 |
|---|---|
| Cosine metric | 0.8819 |
| Dice metric | 0.875 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.19 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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P-Cresol
Similarity: 0.7143
Similarity to P-Cresol
| Tanimoto metric | 0.7143 |
|---|---|
| Cosine metric | 0.8452 |
| Dice metric | 0.8333 |
| MW: | 108.14 |
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|---|---|---|---|---|---|
| PI: | 4
Total passive interactions
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| LogP: | 1.7 |
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| AI: | 0
Total active interactions
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Similarity: 0.5905
Similarity to Benzyl Alcohol
| Tanimoto metric | 0.5905 |
|---|---|
| Cosine metric | 0.7684 |
| Dice metric | 0.7425 |
| MW: | 108.14 |
||||
|---|---|---|---|---|---|
| PI: | 6
Total passive interactions
|
| LogP: | 1.18 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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+35 more
