Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM67492
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM67492 |
| SMILES |
CC(=O)NC(C=O)=CC#N
|
| InChIKey |
CEIHYBXFUUQKDU-UHFFFAOYSA-N
|
| MW [Da] |
138.13
Automatically obtained from RDkit software. |
| LogP |
-0.27
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM51990
Similarity: 0.7111
Similarity to MM51990
| Tanimoto metric | 0.7111 |
|---|---|
| Cosine metric | 0.8433 |
| Dice metric | 0.8312 |
| MW: | 124.1 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM67518
Similarity: 0.6303
Similarity to MM67518
| Tanimoto metric | 0.6303 |
|---|---|
| Cosine metric | 0.7732 |
| Dice metric | 0.7732 |
| MW: | 137.14 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM273699
Similarity: 0.619
Similarity to MM273699
| Tanimoto metric | 0.619 |
|---|---|
| Cosine metric | 0.7647 |
| Dice metric | 0.7647 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.94 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+110 more
