Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM19746
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM19746 |
| SMILES |
Fc1ccc(CCCCNCCCN2CCCCC2)cc1
|
| InChIKey |
QJFRFNMLVHWXGJ-UHFFFAOYSA-N
|
| MW [Da] |
292.44
Automatically obtained from RDkit software. |
| LogP |
3.61
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM19727
Similarity: 0.6607
Similarity to MM19727
| Tanimoto metric | 0.6607 |
|---|---|
| Cosine metric | 0.8128 |
| Dice metric | 0.7957 |
| MW: | 386.53 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 5.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM17455
Similarity: 0.5674
Similarity to MM17455
| Tanimoto metric | 0.5674 |
|---|---|
| Cosine metric | 0.724 |
| Dice metric | 0.724 |
| MW: | 338.99 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 6.49 |
||||
|---|---|---|---|---|---|
| AI: | 1
Total active interactions
|
4-Phenylbutylamine
Similarity: 0.5045
Similarity to 4-Phenylbutylamine
| Tanimoto metric | 0.5045 |
|---|---|
| Cosine metric | 0.7103 |
| Dice metric | 0.6707 |
| MW: | 149.24 |
||||
|---|---|---|---|---|---|
| PI: | 9
Total passive interactions
|
| LogP: | 1.97 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+18 more
