Identifier: MM36952
2D Structure
3D Structure
Source:
General | |
Identifier | MM36952 |
SMILES |
C=CC(C)C=CC=O
|
InChIKey |
ZZYZHOPTOJSYSR-UHFFFAOYSA-N
|
MW [Da] |
110.16
Automatically obtained from RDkit software. |
LogP |
1.56
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM55277
Similarity: 0.9149
Similarity to MM55277
Tanimoto metric | 0.9149 |
---|---|
Cosine metric | 0.9565 |
Dice metric | 0.9556 |
MW: | 122.17 |
||||
---|---|---|---|---|---|
PI: | 1
Total passive interactions
|
LogP: | 1.73 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM158146
Similarity: 0.8776
Similarity to MM158146
Tanimoto metric | 0.8776 |
---|---|
Cosine metric | 0.9368 |
Dice metric | 0.9348 |
MW: | 124.18 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 1.95 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM378764
Similarity: 0.8113
Similarity to MM378764
Tanimoto metric | 0.8113 |
---|---|
Cosine metric | 0.9007 |
Dice metric | 0.8958 |
MW: | 136.19 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 2.12 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+523 more