Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM74804
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM74804 |
| SMILES |
C=CC=C(C)C(O)C(C)=O
|
| InChIKey |
OHIXSHLKDXUJKC-UHFFFAOYSA-N
|
| MW [Da] |
140.18
Automatically obtained from RDkit software. |
| LogP |
1.07
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM161398
Similarity: 0.8067
Similarity to MM161398
| Tanimoto metric | 0.8067 |
|---|---|
| Cosine metric | 0.8981 |
| Dice metric | 0.893 |
| MW: | 128.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.9 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM51045
Similarity: 0.68
Similarity to MM51045
| Tanimoto metric | 0.68 |
|---|---|
| Cosine metric | 0.8246 |
| Dice metric | 0.8095 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM82893
Similarity: 0.6455
Similarity to MM82893
| Tanimoto metric | 0.6455 |
|---|---|
| Cosine metric | 0.7851 |
| Dice metric | 0.7846 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+264 more
