Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM364904
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM364904 |
| SMILES |
CC=COC=CC(C)C#N
|
| InChIKey |
XDYMFHNTHFMJAO-UHFFFAOYSA-N
|
| MW [Da] |
137.18
Automatically obtained from RDkit software. |
| LogP |
2.21
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM169699
Similarity: 0.9385
Similarity to MM169699
| Tanimoto metric | 0.9385 |
|---|---|
| Cosine metric | 0.9687 |
| Dice metric | 0.9683 |
| MW: | 123.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.82 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM36918
Similarity: 0.8
Similarity to MM36918
| Tanimoto metric | 0.8 |
|---|---|
| Cosine metric | 0.8944 |
| Dice metric | 0.8889 |
| MW: | 111.14 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.31 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM241176
Similarity: 0.7821
Similarity to MM241176
| Tanimoto metric | 0.7821 |
|---|---|
| Cosine metric | 0.8795 |
| Dice metric | 0.8777 |
| MW: | 137.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+547 more
