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DocumentationIdentifier: MM260797
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM260797 |
| SMILES |
CC(=CCNC(C)C)CF
|
| InChIKey |
GNWQJXGMXFUVMO-UHFFFAOYSA-N
|
| MW [Da] |
145.22
Automatically obtained from RDkit software. |
| LogP |
1.9
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM170982
Similarity: 0.8889
Similarity to MM170982
| Tanimoto metric | 0.8889 |
|---|---|
| Cosine metric | 0.9428 |
| Dice metric | 0.9412 |
| MW: | 131.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.51 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM369932
Similarity: 0.8421
Similarity to MM369932
| Tanimoto metric | 0.8421 |
|---|---|
| Cosine metric | 0.9147 |
| Dice metric | 0.9143 |
| MW: | 143.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM369787
Similarity: 0.7805
Similarity to MM369787
| Tanimoto metric | 0.7805 |
|---|---|
| Cosine metric | 0.8768 |
| Dice metric | 0.8767 |
| MW: | 145.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.9 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+631 more
