Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM370149
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM370149 |
| SMILES |
C#CC=CCNC(=N)C#C
|
| InChIKey |
UEIORSRQOPJTLD-UHFFFAOYSA-N
|
| MW [Da] |
132.17
Automatically obtained from RDkit software. |
| LogP |
0.38
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM370046
Similarity: 0.8065
Similarity to MM370046
| Tanimoto metric | 0.8065 |
|---|---|
| Cosine metric | 0.8929 |
| Dice metric | 0.8929 |
| MW: | 137.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM82653
Similarity: 0.7426
Similarity to MM82653
| Tanimoto metric | 0.7426 |
|---|---|
| Cosine metric | 0.8528 |
| Dice metric | 0.8523 |
| MW: | 136.15 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM82972
Similarity: 0.7412
Similarity to MM82972
| Tanimoto metric | 0.7412 |
|---|---|
| Cosine metric | 0.8609 |
| Dice metric | 0.8514 |
| MW: | 108.14 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+296 more
