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DocumentationIdentifier: MM261264
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM261264 |
| SMILES |
COC(C)CC(C)CCN
|
| InChIKey |
VMBPPODWPCBWBR-UHFFFAOYSA-N
|
| MW [Da] |
145.25
Automatically obtained from RDkit software. |
| LogP |
1.4
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM141576
Similarity: 0.7263
Similarity to MM141576
| Tanimoto metric | 0.7263 |
|---|---|
| Cosine metric | 0.8522 |
| Dice metric | 0.8415 |
| MW: | 130.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM325834
Similarity: 0.7155
Similarity to MM325834
| Tanimoto metric | 0.7155 |
|---|---|
| Cosine metric | 0.835 |
| Dice metric | 0.8342 |
| MW: | 145.25 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM325750
Similarity: 0.6832
Similarity to MM325750
| Tanimoto metric | 0.6832 |
|---|---|
| Cosine metric | 0.8174 |
| Dice metric | 0.8118 |
| MW: | 144.26 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.85 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+535 more
