Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM178047
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM178047 |
| SMILES |
C=CCN(C=N)CC=C
|
| InChIKey |
DHVSEWFXZZFWIJ-UHFFFAOYSA-N
|
| MW [Da] |
124.19
Automatically obtained from RDkit software. |
| LogP |
1.27
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM178198
Similarity: 0.7286
Similarity to MM178198
| Tanimoto metric | 0.7286 |
|---|---|
| Cosine metric | 0.8479 |
| Dice metric | 0.843 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM97984
Similarity: 0.7222
Similarity to MM97984
| Tanimoto metric | 0.7222 |
|---|---|
| Cosine metric | 0.8498 |
| Dice metric | 0.8387 |
| MW: | 98.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM305485
Similarity: 0.7105
Similarity to MM305485
| Tanimoto metric | 0.7105 |
|---|---|
| Cosine metric | 0.8429 |
| Dice metric | 0.8308 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+257 more
