Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM363851
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM363851 |
| SMILES |
C#CCOC=CC(C)C=O
|
| InChIKey |
BXIADJDOSBNORK-UHFFFAOYSA-N
|
| MW [Da] |
138.17
Automatically obtained from RDkit software. |
| LogP |
0.98
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM169617
Similarity: 0.8354
Similarity to MM169617
| Tanimoto metric | 0.8354 |
|---|---|
| Cosine metric | 0.914 |
| Dice metric | 0.9103 |
| MW: | 128.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM215086
Similarity: 0.7848
Similarity to MM215086
| Tanimoto metric | 0.7848 |
|---|---|
| Cosine metric | 0.8859 |
| Dice metric | 0.8794 |
| MW: | 124.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM425576
Similarity: 0.7586
Similarity to MM425576
| Tanimoto metric | 0.7586 |
|---|---|
| Cosine metric | 0.8632 |
| Dice metric | 0.8627 |
| MW: | 142.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+375 more
