Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM281777
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM281777 |
| SMILES |
CCCC=CC(=O)OCC
|
| InChIKey |
SJRXWMQZUAOMRJ-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
1.91
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM169835
Similarity: 0.8222
Similarity to MM169835
| Tanimoto metric | 0.8222 |
|---|---|
| Cosine metric | 0.9068 |
| Dice metric | 0.9024 |
| MW: | 128.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM357784
Similarity: 0.798
Similarity to MM357784
| Tanimoto metric | 0.798 |
|---|---|
| Cosine metric | 0.8877 |
| Dice metric | 0.8876 |
| MW: | 140.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM281778
Similarity: 0.7477
Similarity to MM281778
| Tanimoto metric | 0.7477 |
|---|---|
| Cosine metric | 0.8562 |
| Dice metric | 0.8556 |
| MW: | 146.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.47 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+539 more
