Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM250877
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM250877 |
| SMILES |
CCOC(=O)CCC(C)O
|
| InChIKey |
RATJOUJXNFFTQR-UHFFFAOYSA-N
|
| MW [Da] |
146.19
Automatically obtained from RDkit software. |
| LogP |
0.71
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM43781
Similarity: 0.8247
Similarity to MM43781
| Tanimoto metric | 0.8247 |
|---|---|
| Cosine metric | 0.9082 |
| Dice metric | 0.904 |
| MW: | 132.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.32 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM316462
Similarity: 0.708
Similarity to MM316462
| Tanimoto metric | 0.708 |
|---|---|
| Cosine metric | 0.829 |
| Dice metric | 0.829 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.97 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM316421
Similarity: 0.6957
Similarity to MM316421
| Tanimoto metric | 0.6957 |
|---|---|
| Cosine metric | 0.8205 |
| Dice metric | 0.8205 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+564 more
