Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM403073
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM403073 |
| SMILES |
C=CC(CO)NCCNC
|
| InChIKey |
ZESBNIDPLBCCLZ-UHFFFAOYSA-N
|
| MW [Da] |
144.22
Automatically obtained from RDkit software. |
| LogP |
-0.66
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM198847
Similarity: 0.8837
Similarity to MM198847
| Tanimoto metric | 0.8837 |
|---|---|
| Cosine metric | 0.9401 |
| Dice metric | 0.9383 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.92 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM326767
Similarity: 0.717
Similarity to MM326767
| Tanimoto metric | 0.717 |
|---|---|
| Cosine metric | 0.8364 |
| Dice metric | 0.8352 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.53 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM59089
Similarity: 0.6977
Similarity to MM59089
| Tanimoto metric | 0.6977 |
|---|---|
| Cosine metric | 0.8353 |
| Dice metric | 0.8219 |
| MW: | 115.18 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+496 more
