Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM281227
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM281227 |
| SMILES |
C#CC#CCC(=O)CC#C
|
| InChIKey |
QOOUDDBJNJRDRS-UHFFFAOYSA-N
|
| MW [Da] |
130.15
Automatically obtained from RDkit software. |
| LogP |
0.61
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM169269
Similarity: 0.9412
Similarity to MM169269
| Tanimoto metric | 0.9412 |
|---|---|
| Cosine metric | 0.9701 |
| Dice metric | 0.9697 |
| MW: | 120.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.99 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM362728
Similarity: 0.8421
Similarity to MM362728
| Tanimoto metric | 0.8421 |
|---|---|
| Cosine metric | 0.9147 |
| Dice metric | 0.9143 |
| MW: | 134.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.38 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM157089
Similarity: 0.8235
Similarity to MM157089
| Tanimoto metric | 0.8235 |
|---|---|
| Cosine metric | 0.9075 |
| Dice metric | 0.9032 |
| MW: | 120.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.99 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+251 more
