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DocumentationIdentifier: MM325006
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM325006 |
| SMILES |
CCC(C)NCC1(C)CC1
|
| InChIKey |
RLYWZMVWXWFLGH-UHFFFAOYSA-N
|
| MW [Da] |
141.26
Automatically obtained from RDkit software. |
| LogP |
2.17
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM149489
Similarity: 0.8652
Similarity to MM149489
| Tanimoto metric | 0.8652 |
|---|---|
| Cosine metric | 0.9301 |
| Dice metric | 0.9277 |
| MW: | 127.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.78 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM210322
Similarity: 0.8351
Similarity to MM210322
| Tanimoto metric | 0.8351 |
|---|---|
| Cosine metric | 0.9101 |
| Dice metric | 0.9101 |
| MW: | 125.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.54 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM230914
Similarity: 0.8021
Similarity to MM230914
| Tanimoto metric | 0.8021 |
|---|---|
| Cosine metric | 0.8905 |
| Dice metric | 0.8902 |
| MW: | 141.26 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+327 more
