Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM279772
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM279772 |
| SMILES |
CCC=CCN(C)CCO
|
| InChIKey |
ZWXYJIFNWMDGKX-UHFFFAOYSA-N
|
| MW [Da] |
143.23
Automatically obtained from RDkit software. |
| LogP |
0.88
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM156737
Similarity: 0.8158
Similarity to MM156737
| Tanimoto metric | 0.8158 |
|---|---|
| Cosine metric | 0.9032 |
| Dice metric | 0.8986 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM279773
Similarity: 0.747
Similarity to MM279773
| Tanimoto metric | 0.747 |
|---|---|
| Cosine metric | 0.8562 |
| Dice metric | 0.8552 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM168131
Similarity: 0.7368
Similarity to MM168131
| Tanimoto metric | 0.7368 |
|---|---|
| Cosine metric | 0.8584 |
| Dice metric | 0.8485 |
| MW: | 127.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.9 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+508 more
