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DocumentationIdentifier: MM374538
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM374538 |
| SMILES |
CNCCCCC1(C)CN1
|
| InChIKey |
OULKLEPLIGMHAX-UHFFFAOYSA-N
|
| MW [Da] |
142.25
Automatically obtained from RDkit software. |
| LogP |
0.74
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM176141
Similarity: 0.9796
Similarity to MM176141
| Tanimoto metric | 0.9796 |
|---|---|
| Cosine metric | 0.9897 |
| Dice metric | 0.9897 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM374536
Similarity: 0.8491
Similarity to MM374536
| Tanimoto metric | 0.8491 |
|---|---|
| Cosine metric | 0.9184 |
| Dice metric | 0.9184 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM271313
Similarity: 0.7559
Similarity to MM271313
| Tanimoto metric | 0.7559 |
|---|---|
| Cosine metric | 0.8674 |
| Dice metric | 0.861 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.72 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+261 more
