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DocumentationIdentifier: MM385872
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM385872 |
| SMILES |
CCCNC(CO)CCC
|
| InChIKey |
ZGPZGMHNOLLVOM-UHFFFAOYSA-N
|
| MW [Da] |
145.25
Automatically obtained from RDkit software. |
| LogP |
1.15
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM385874
Similarity: 0.8804
Similarity to MM385874
| Tanimoto metric | 0.8804 |
|---|---|
| Cosine metric | 0.9368 |
| Dice metric | 0.9364 |
| MW: | 147.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM402209
Similarity: 0.8295
Similarity to MM402209
| Tanimoto metric | 0.8295 |
|---|---|
| Cosine metric | 0.9077 |
| Dice metric | 0.9068 |
| MW: | 145.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM198571
Similarity: 0.8095
Similarity to MM198571
| Tanimoto metric | 0.8095 |
|---|---|
| Cosine metric | 0.8997 |
| Dice metric | 0.8947 |
| MW: | 131.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.76 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+632 more
