Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM386047
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM386047 |
| SMILES |
CNC(CCO)COC=O
|
| InChIKey |
VCZXFNMGXNJZLQ-UHFFFAOYSA-N
|
| MW [Da] |
147.17
Automatically obtained from RDkit software. |
| LogP |
-0.87
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM402430
Similarity: 0.7034
Similarity to MM402430
| Tanimoto metric | 0.7034 |
|---|---|
| Cosine metric | 0.8267 |
| Dice metric | 0.8259 |
| MW: | 147.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM386045
Similarity: 0.688
Similarity to MM386045
| Tanimoto metric | 0.688 |
|---|---|
| Cosine metric | 0.8152 |
| Dice metric | 0.8152 |
| MW: | 145.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM62150
Similarity: 0.6585
Similarity to MM62150
| Tanimoto metric | 0.6585 |
|---|---|
| Cosine metric | 0.7945 |
| Dice metric | 0.7941 |
| MW: | 147.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+302 more
