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DocumentationIdentifier: MM363066
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM363066 |
| SMILES |
CNC(C)COCCCF
|
| InChIKey |
IGKAYDYXQRITEQ-UHFFFAOYSA-N
|
| MW [Da] |
149.21
Automatically obtained from RDkit software. |
| LogP |
0.97
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM165616
Similarity: 0.8052
Similarity to MM165616
| Tanimoto metric | 0.8052 |
|---|---|
| Cosine metric | 0.8973 |
| Dice metric | 0.8921 |
| MW: | 131.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM363068
Similarity: 0.7284
Similarity to MM363068
| Tanimoto metric | 0.7284 |
|---|---|
| Cosine metric | 0.8471 |
| Dice metric | 0.8429 |
| MW: | 146.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM73054
Similarity: 0.7273
Similarity to MM73054
| Tanimoto metric | 0.7273 |
|---|---|
| Cosine metric | 0.8528 |
| Dice metric | 0.8421 |
| MW: | 135.18 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.58 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+450 more
