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DocumentationIdentifier: MM309035
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM309035 |
| SMILES |
C#CC(C)(CF)NCCF
|
| InChIKey |
RTLIFUQMPIOFQE-UHFFFAOYSA-N
|
| MW [Da] |
147.17
Automatically obtained from RDkit software. |
| LogP |
0.91
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM309033
Similarity: 0.7603
Similarity to MM309033
| Tanimoto metric | 0.7603 |
|---|---|
| Cosine metric | 0.8643 |
| Dice metric | 0.8638 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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| Tanimoto metric | 0.736 |
|---|---|
| Cosine metric | 0.849 |
| Dice metric | 0.8479 |
| MW: | 143.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM227911
Similarity: 0.5983
Similarity to MM227911
| Tanimoto metric | 0.5983 |
|---|---|
| Cosine metric | 0.7526 |
| Dice metric | 0.7487 |
| MW: | 147.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+178 more
