Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM63966
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM63966 |
| SMILES |
C#CC(=N)N(C)C=CC=O
|
| InChIKey |
FKOCTSQTQXOSCO-UHFFFAOYSA-N
|
| MW [Da] |
136.15
Automatically obtained from RDkit software. |
| LogP |
0.24
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM163314
Similarity: 0.7236
Similarity to MM163314
| Tanimoto metric | 0.7236 |
|---|---|
| Cosine metric | 0.8506 |
| Dice metric | 0.8396 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.63 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM66667
Similarity: 0.7194
Similarity to MM66667
| Tanimoto metric | 0.7194 |
|---|---|
| Cosine metric | 0.8372 |
| Dice metric | 0.8368 |
| MW: | 132.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM295739
Similarity: 0.6993
Similarity to MM295739
| Tanimoto metric | 0.6993 |
|---|---|
| Cosine metric | 0.8231 |
| Dice metric | 0.823 |
| MW: | 136.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+169 more
