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DocumentationIdentifier: MM250486
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM250486 |
| SMILES |
CNCC(N)CCC(F)F
|
| InChIKey |
HTMNYLNVMUZJIN-UHFFFAOYSA-N
|
| MW [Da] |
152.19
Automatically obtained from RDkit software. |
| LogP |
0.58
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM90648
Similarity: 0.8214
Similarity to MM90648
| Tanimoto metric | 0.8214 |
|---|---|
| Cosine metric | 0.9063 |
| Dice metric | 0.902 |
| MW: | 134.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM143999
Similarity: 0.7738
Similarity to MM143999
| Tanimoto metric | 0.7738 |
|---|---|
| Cosine metric | 0.8797 |
| Dice metric | 0.8725 |
| MW: | 138.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.32 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM339718
Similarity: 0.74
Similarity to MM339718
| Tanimoto metric | 0.74 |
|---|---|
| Cosine metric | 0.8511 |
| Dice metric | 0.8506 |
| MW: | 152.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.58 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+485 more
