Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM386046
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM386046 |
| SMILES |
CCCC(C#N)=COCC
|
| InChIKey |
LGEQBTCASTUUOL-UHFFFAOYSA-N
|
| MW [Da] |
139.2
Automatically obtained from RDkit software. |
| LogP |
2.23
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM201726
Similarity: 0.7941
Similarity to MM201726
| Tanimoto metric | 0.7941 |
|---|---|
| Cosine metric | 0.8911 |
| Dice metric | 0.8852 |
| MW: | 125.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.84 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM437994
Similarity: 0.7568
Similarity to MM437994
| Tanimoto metric | 0.7568 |
|---|---|
| Cosine metric | 0.8625 |
| Dice metric | 0.8615 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.23 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM386122
Similarity: 0.7241
Similarity to MM386122
| Tanimoto metric | 0.7241 |
|---|---|
| Cosine metric | 0.8402 |
| Dice metric | 0.84 |
| MW: | 137.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+556 more
