Identifier: MM178361
2D Structure
3D Structure
Source:
General | |
Identifier | MM178361 |
SMILES |
CC#CC(CO)NC=N
|
InChIKey |
YGHBMJUWSLVSFO-UHFFFAOYSA-N
|
MW [Da] |
126.16
Automatically obtained from RDkit software. |
LogP |
-0.43
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM379724
Similarity: 0.8654
Similarity to MM379724
Tanimoto metric | 0.8654 |
---|---|
Cosine metric | 0.9303 |
Dice metric | 0.9278 |
MW: | 140.19 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | -0.04 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM379851
Similarity: 0.8257
Similarity to MM379851
Tanimoto metric | 0.8257 |
---|---|
Cosine metric | 0.9087 |
Dice metric | 0.9045 |
MW: | 136.15 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | -0.82 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM389528
Similarity: 0.8257
Similarity to MM389528
Tanimoto metric | 0.8257 |
---|---|
Cosine metric | 0.9087 |
Dice metric | 0.9045 |
MW: | 140.19 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | -0.38 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+310 more