Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM245972
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM245972 |
| SMILES |
C=C(CC(N)CC)C(C)O
|
| InChIKey |
ZGLWOTYVGUQGPQ-UHFFFAOYSA-N
|
| MW [Da] |
143.23
Automatically obtained from RDkit software. |
| LogP |
1.05
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM133809
Similarity: 0.811
Similarity to MM133809
| Tanimoto metric | 0.811 |
|---|---|
| Cosine metric | 0.9006 |
| Dice metric | 0.8957 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM269135
Similarity: 0.7431
Similarity to MM269135
| Tanimoto metric | 0.7431 |
|---|---|
| Cosine metric | 0.8527 |
| Dice metric | 0.8526 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM245974
Similarity: 0.7315
Similarity to MM245974
| Tanimoto metric | 0.7315 |
|---|---|
| Cosine metric | 0.8451 |
| Dice metric | 0.845 |
| MW: | 145.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+484 more
