Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM378129
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM378129 |
| SMILES |
C=CC(C=CCN)NC=N
|
| InChIKey |
OFJKTYAGNIXKIJ-UHFFFAOYSA-N
|
| MW [Da] |
139.2
Automatically obtained from RDkit software. |
| LogP |
0.25
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM389147
Similarity: 0.71
Similarity to MM389147
| Tanimoto metric | 0.71 |
|---|---|
| Cosine metric | 0.8304 |
| Dice metric | 0.8304 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.36 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM107553
Similarity: 0.6824
Similarity to MM107553
| Tanimoto metric | 0.6824 |
|---|---|
| Cosine metric | 0.826 |
| Dice metric | 0.8112 |
| MW: | 112.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM378237
Similarity: 0.6667
Similarity to MM378237
| Tanimoto metric | 0.6667 |
|---|---|
| Cosine metric | 0.8012 |
| Dice metric | 0.8 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+192 more
