Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM357754
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM357754 |
| SMILES |
C=CCNC(=N)C=CCN
|
| InChIKey |
MAPSAZWMUYAACV-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
MM157941
Similarity: 0.878
Similarity to MM157941
| Tanimoto metric | 0.878 |
|---|---|
| Cosine metric | 0.937 |
| Dice metric | 0.9351 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM279447
Similarity: 0.814
Similarity to MM279447
| Tanimoto metric | 0.814 |
|---|---|
| Cosine metric | 0.8986 |
| Dice metric | 0.8974 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM369760
Similarity: 0.7727
Similarity to MM369760
| Tanimoto metric | 0.7727 |
|---|---|
| Cosine metric | 0.8729 |
| Dice metric | 0.8718 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+453 more
