Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM45115
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM45115 |
| SMILES |
CC(=O)OCC=CCO
|
| InChIKey |
MIKNOVPHRJOEBB-UHFFFAOYSA-N
|
| MW [Da] |
130.14
Automatically obtained from RDkit software. |
| LogP |
0.1
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM105932
Similarity: 0.8689
Similarity to MM105932
| Tanimoto metric | 0.8689 |
|---|---|
| Cosine metric | 0.9321 |
| Dice metric | 0.9298 |
| MW: | 114.14 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM153378
Similarity: 0.726
Similarity to MM153378
| Tanimoto metric | 0.726 |
|---|---|
| Cosine metric | 0.8417 |
| Dice metric | 0.8413 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM153379
Similarity: 0.726
Similarity to MM153379
| Tanimoto metric | 0.726 |
|---|---|
| Cosine metric | 0.8417 |
| Dice metric | 0.8413 |
| MW: | 128.13 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+379 more
