Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM252755
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM252755 |
| SMILES |
C=C(C)C#CC(F)CC=O
|
| InChIKey |
QQEVKXQQTAKFNI-UHFFFAOYSA-N
|
| MW [Da] |
140.16
Automatically obtained from RDkit software. |
| LogP |
1.49
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM46916
Similarity: 0.7864
Similarity to MM46916
| Tanimoto metric | 0.7864 |
|---|---|
| Cosine metric | 0.8868 |
| Dice metric | 0.8804 |
| MW: | 126.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM146015
Similarity: 0.7767
Similarity to MM146015
| Tanimoto metric | 0.7767 |
|---|---|
| Cosine metric | 0.8813 |
| Dice metric | 0.8743 |
| MW: | 126.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.31 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM282703
Similarity: 0.6991
Similarity to MM282703
| Tanimoto metric | 0.6991 |
|---|---|
| Cosine metric | 0.8251 |
| Dice metric | 0.8229 |
| MW: | 140.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+477 more
