Identifier: MM49671
2D Structure
3D Structure
Source:
General | |
Identifier | MM49671 |
SMILES |
N#CC=CC(=N)NCC#N
|
InChIKey |
IIWMMPLUEOFFBC-UHFFFAOYSA-N
|
MW [Da] |
134.14
Automatically obtained from RDkit software. |
LogP |
0.16
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM83000
Similarity: 0.8511
Similarity to MM83000
Tanimoto metric | 0.8511 |
---|---|
Cosine metric | 0.9225 |
Dice metric | 0.9195 |
MW: | 123.16 |
||||
---|---|---|---|---|---|
PI: | 1
Total passive interactions
|
LogP: | 0.65 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM77081
Similarity: 0.7339
Similarity to MM77081
Tanimoto metric | 0.7339 |
---|---|
Cosine metric | 0.8466 |
Dice metric | 0.8466 |
MW: | 135.17 |
||||
---|---|---|---|---|---|
PI: | 1
Total passive interactions
|
LogP: | 0.82 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM82423
Similarity: 0.7143
Similarity to MM82423
Tanimoto metric | 0.7143 |
---|---|
Cosine metric | 0.8335 |
Dice metric | 0.8333 |
MW: | 137.19 |
||||
---|---|---|---|---|---|
PI: | 1
Total passive interactions
|
LogP: | 1.04 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+298 more