Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM381787
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM381787 |
| SMILES |
C=C(CC)C(=CC)CC=O
|
| InChIKey |
ZSXXSBAKPZANET-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
2.49
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM180431
Similarity: 0.8269
Similarity to MM180431
| Tanimoto metric | 0.8269 |
|---|---|
| Cosine metric | 0.9094 |
| Dice metric | 0.9053 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM306358
Similarity: 0.7667
Similarity to MM306358
| Tanimoto metric | 0.7667 |
|---|---|
| Cosine metric | 0.8681 |
| Dice metric | 0.8679 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM174894
Similarity: 0.7364
Similarity to MM174894
| Tanimoto metric | 0.7364 |
|---|---|
| Cosine metric | 0.8515 |
| Dice metric | 0.8482 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+408 more
