Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM379190
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM379190 |
| SMILES |
CC=C(C=CCN)NC=N
|
| InChIKey |
XKXSMHYPVZDQCP-UHFFFAOYSA-N
|
| MW [Da] |
139.2
Automatically obtained from RDkit software. |
| LogP |
0.6
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM178714
Similarity: 0.8515
Similarity to MM178714
| Tanimoto metric | 0.8515 |
|---|---|
| Cosine metric | 0.9228 |
| Dice metric | 0.9198 |
| MW: | 124.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM304674
Similarity: 0.7931
Similarity to MM304674
| Tanimoto metric | 0.7931 |
|---|---|
| Cosine metric | 0.885 |
| Dice metric | 0.8846 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM116552
Similarity: 0.6733
Similarity to MM116552
| Tanimoto metric | 0.6733 |
|---|---|
| Cosine metric | 0.8205 |
| Dice metric | 0.8047 |
| MW: | 110.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+122 more
