2-Phenylethanol
2D Structure
3D Structure
Source:
General | |
Identifier | MM00794 |
SMILES |
OCCc1ccccc1
|
InChIKey |
WRMNZCZEMHIOCP-UHFFFAOYSA-N
|
MW [Da] |
122.17
Automatically obtained from RDkit software. |
LogP |
1.22
Automatically obtained from RDkit software. |
Links | |
PubChem |
6054
|
DrugBank |
DB02192
|
ChEBI |
49000
|
PDB |
PEL
|
ChEMBL |
CHEMBL448500
|
Similar entries
Ethylbenzene
Similarity: 0.7412
Similarity to Ethylbenzene
Tanimoto metric | 0.7412 |
---|---|
Cosine metric | 0.8609 |
Dice metric | 0.8514 |
MW: | 106.17 |
||||
---|---|---|---|---|---|
PI: | 6
Total passive interactions
|
LogP: | 2.25 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
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4a6
Similarity: 0.5294
Similarity to 4a6
Tanimoto metric | 0.5294 |
---|---|
Cosine metric | 0.6938 |
Dice metric | 0.6923 |
MW: | 134.22 |
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---|---|---|---|---|---|
PI: | 1
Total passive interactions
|
LogP: | 3.12 |
||||
---|---|---|---|---|---|
AI: | 1
Total active interactions
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Phenelzine
Similarity: 0.5122
Similarity to Phenelzine
Tanimoto metric | 0.5122 |
---|---|
Cosine metric | 0.6799 |
Dice metric | 0.6774 |
MW: | 136.2 |
||||
---|---|---|---|---|---|
PI: | 8
Total passive interactions
|
LogP: | 0.69 |
||||
---|---|---|---|---|---|
AI: | 2
Total active interactions
|
+28 more