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DocumentationIdentifier: MM224124
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM224124 |
| SMILES |
COC(CO)CC(C)(C)O
|
| InChIKey |
IQBYLRANIBVSPS-UHFFFAOYSA-N
|
| MW [Da] |
148.2
Automatically obtained from RDkit software. |
| LogP |
0.15
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM57792
Similarity: 0.812
Similarity to MM57792
| Tanimoto metric | 0.812 |
|---|---|
| Cosine metric | 0.8963 |
| Dice metric | 0.8962 |
| MW: | 148.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM58230
Similarity: 0.7519
Similarity to MM58230
| Tanimoto metric | 0.7519 |
|---|---|
| Cosine metric | 0.8612 |
| Dice metric | 0.8584 |
| MW: | 148.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM226058
Similarity: 0.748
Similarity to MM226058
| Tanimoto metric | 0.748 |
|---|---|
| Cosine metric | 0.8564 |
| Dice metric | 0.8559 |
| MW: | 148.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+378 more
