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DocumentationIdentifier: MM291132
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM291132 |
| SMILES |
NCCC(N)CNCCF
|
| InChIKey |
GYEKLOMQCSKBDM-UHFFFAOYSA-N
|
| MW [Da] |
149.21
Automatically obtained from RDkit software. |
| LogP |
-0.78
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM165546
Similarity: 0.8272
Similarity to MM165546
| Tanimoto metric | 0.8272 |
|---|---|
| Cosine metric | 0.9095 |
| Dice metric | 0.9054 |
| MW: | 134.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM257572
Similarity: 0.7053
Similarity to MM257572
| Tanimoto metric | 0.7053 |
|---|---|
| Cosine metric | 0.8272 |
| Dice metric | 0.8272 |
| MW: | 152.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.58 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM73446
Similarity: 0.6768
Similarity to MM73446
| Tanimoto metric | 0.6768 |
|---|---|
| Cosine metric | 0.8075 |
| Dice metric | 0.8072 |
| MW: | 148.23 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+413 more
