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DocumentationIdentifier: MM180958
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM180958 |
| SMILES |
COC(C(C)N)C(C)O
|
| InChIKey |
APDYSKSVUSPERD-UHFFFAOYSA-N
|
| MW [Da] |
133.19
Automatically obtained from RDkit software. |
| LogP |
-0.27
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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MM387936
Similarity: 0.8099
Similarity to MM387936
| Tanimoto metric | 0.8099 |
|---|---|
| Cosine metric | 0.8999 |
| Dice metric | 0.8949 |
| MW: | 147.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM60885
Similarity: 0.7877
Similarity to MM60885
| Tanimoto metric | 0.7877 |
|---|---|
| Cosine metric | 0.8875 |
| Dice metric | 0.8812 |
| MW: | 147.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM61917
Similarity: 0.7718
Similarity to MM61917
| Tanimoto metric | 0.7718 |
|---|---|
| Cosine metric | 0.8785 |
| Dice metric | 0.8712 |
| MW: | 147.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+306 more
