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DocumentationIdentifier: MM291252
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM291252 |
| SMILES |
CCCC(O)CCOC=O
|
| InChIKey |
ISMFLXDVIRRBDO-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
MM83048
Similarity: 0.7073
Similarity to MM83048
| Tanimoto metric | 0.7073 |
|---|---|
| Cosine metric | 0.8316 |
| Dice metric | 0.8286 |
| MW: | 148.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM402446
Similarity: 0.7033
Similarity to MM402446
| Tanimoto metric | 0.7033 |
|---|---|
| Cosine metric | 0.826 |
| Dice metric | 0.8258 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.97 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM301155
Similarity: 0.6809
Similarity to MM301155
| Tanimoto metric | 0.6809 |
|---|---|
| Cosine metric | 0.8107 |
| Dice metric | 0.8101 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+491 more
