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DocumentationIdentifier: MM78327
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM78327 |
| SMILES |
C=C(C)C(C)(O)CCCN
|
| InChIKey |
NYGWRVNUTCRNQE-UHFFFAOYSA-N
|
| MW [Da] |
143.23
Automatically obtained from RDkit software. |
| LogP |
1.05
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM308369
Similarity: 0.7664
Similarity to MM308369
| Tanimoto metric | 0.7664 |
|---|---|
| Cosine metric | 0.8707 |
| Dice metric | 0.8678 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM242143
Similarity: 0.7226
Similarity to MM242143
| Tanimoto metric | 0.7226 |
|---|---|
| Cosine metric | 0.8391 |
| Dice metric | 0.839 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM78383
Similarity: 0.6565
Similarity to MM78383
| Tanimoto metric | 0.6565 |
|---|---|
| Cosine metric | 0.8102 |
| Dice metric | 0.7926 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+444 more
