Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM236117
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM236117 |
| SMILES |
CC(=O)C#CC=CC(C)C
|
| InChIKey |
AXXZHGZJIZPWGQ-UHFFFAOYSA-N
|
| MW [Da] |
136.19
Automatically obtained from RDkit software. |
| LogP |
1.79
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM154720
Similarity: 0.8889
Similarity to MM154720
| Tanimoto metric | 0.8889 |
|---|---|
| Cosine metric | 0.9428 |
| Dice metric | 0.9412 |
| MW: | 122.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM290051
Similarity: 0.8205
Similarity to MM290051
| Tanimoto metric | 0.8205 |
|---|---|
| Cosine metric | 0.9015 |
| Dice metric | 0.9014 |
| MW: | 136.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.94 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM106498
Similarity: 0.75
Similarity to MM106498
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.866 |
| Dice metric | 0.8571 |
| MW: | 108.14 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+563 more
