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DocumentationIdentifier: MM77605
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM77605 |
| SMILES |
C=CCCC(C)(O)C(C)N
|
| InChIKey |
BLBWMGSNFCMLJM-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
MM241883
Similarity: 0.7285
Similarity to MM241883
| Tanimoto metric | 0.7285 |
|---|---|
| Cosine metric | 0.8434 |
| Dice metric | 0.8429 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM233078
Similarity: 0.6828
Similarity to MM233078
| Tanimoto metric | 0.6828 |
|---|---|
| Cosine metric | 0.8119 |
| Dice metric | 0.8115 |
| MW: | 145.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM69260
Similarity: 0.6587
Similarity to MM69260
| Tanimoto metric | 0.6587 |
|---|---|
| Cosine metric | 0.8116 |
| Dice metric | 0.7943 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+359 more
