Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM450180
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM450180 |
| SMILES |
CC#CCOCC#CC=O
|
| InChIKey |
JXJNFHFUJBXOSG-UHFFFAOYSA-N
|
| MW [Da] |
136.15
Automatically obtained from RDkit software. |
| LogP |
0.23
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM126408
Similarity: 0.9167
Similarity to MM126408
| Tanimoto metric | 0.9167 |
|---|---|
| Cosine metric | 0.9574 |
| Dice metric | 0.9565 |
| MW: | 112.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.23 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM214237
Similarity: 0.7895
Similarity to MM214237
| Tanimoto metric | 0.7895 |
|---|---|
| Cosine metric | 0.8839 |
| Dice metric | 0.8824 |
| MW: | 128.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.8 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM214338
Similarity: 0.7857
Similarity to MM214338
| Tanimoto metric | 0.7857 |
|---|---|
| Cosine metric | 0.8807 |
| Dice metric | 0.88 |
| MW: | 126.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+525 more
