Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM424006
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM424006 |
| SMILES |
CCCC=CC(C#N)NC
|
| InChIKey |
RLXQYYPBKRWTKF-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
1.45
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM424640
Similarity: 0.7921
Similarity to MM424640
| Tanimoto metric | 0.7921 |
|---|---|
| Cosine metric | 0.8843 |
| Dice metric | 0.884 |
| MW: | 135.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM455861
Similarity: 0.775
Similarity to MM455861
| Tanimoto metric | 0.775 |
|---|---|
| Cosine metric | 0.8803 |
| Dice metric | 0.8732 |
| MW: | 136.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM343473
Similarity: 0.7407
Similarity to MM343473
| Tanimoto metric | 0.7407 |
|---|---|
| Cosine metric | 0.8511 |
| Dice metric | 0.8511 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.31 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+328 more
