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DocumentationIdentifier: MM363080
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM363080 |
| SMILES |
CCCCCNC(C)CF
|
| InChIKey |
IHMKBOHNMXXNNO-UHFFFAOYSA-N
|
| MW [Da] |
147.24
Automatically obtained from RDkit software. |
| LogP |
2.12
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM165630
Similarity: 0.8841
Similarity to MM165630
| Tanimoto metric | 0.8841 |
|---|---|
| Cosine metric | 0.9402 |
| Dice metric | 0.9385 |
| MW: | 133.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM363082
Similarity: 0.8133
Similarity to MM363082
| Tanimoto metric | 0.8133 |
|---|---|
| Cosine metric | 0.8972 |
| Dice metric | 0.8971 |
| MW: | 151.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM257615
Similarity: 0.7722
Similarity to MM257615
| Tanimoto metric | 0.7722 |
|---|---|
| Cosine metric | 0.8715 |
| Dice metric | 0.8714 |
| MW: | 147.24 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.98 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+662 more
