Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM288291
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM288291 |
| SMILES |
CCCC#CCCC(N)=O
|
| InChIKey |
KANSZFMNZKHRCX-UHFFFAOYSA-N
|
| MW [Da] |
139.2
Automatically obtained from RDkit software. |
| LogP |
1.06
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM153462
Similarity: 0.9683
Similarity to MM153462
| Tanimoto metric | 0.9683 |
|---|---|
| Cosine metric | 0.984 |
| Dice metric | 0.9839 |
| MW: | 125.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM68653
Similarity: 0.9104
Similarity to MM68653
| Tanimoto metric | 0.9104 |
|---|---|
| Cosine metric | 0.9532 |
| Dice metric | 0.9531 |
| MW: | 139.15 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM288292
Similarity: 0.9104
Similarity to MM288292
| Tanimoto metric | 0.9104 |
|---|---|
| Cosine metric | 0.9532 |
| Dice metric | 0.9531 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+118 more
