Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM361072
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM361072 |
| SMILES |
C=CCC=C(C)C#CC=O
|
| InChIKey |
YFUYNYQNSNUPNL-UHFFFAOYSA-N
|
| MW [Da] |
134.18
Automatically obtained from RDkit software. |
| LogP |
1.71
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM159342
Similarity: 0.8605
Similarity to MM159342
| Tanimoto metric | 0.8605 |
|---|---|
| Cosine metric | 0.9276 |
| Dice metric | 0.925 |
| MW: | 122.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM159862
Similarity: 0.7674
Similarity to MM159862
| Tanimoto metric | 0.7674 |
|---|---|
| Cosine metric | 0.876 |
| Dice metric | 0.8684 |
| MW: | 120.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.53 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM285160
Similarity: 0.7253
Similarity to MM285160
| Tanimoto metric | 0.7253 |
|---|---|
| Cosine metric | 0.8446 |
| Dice metric | 0.8408 |
| MW: | 134.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.92 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+327 more
