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DocumentationIdentifier: MM312335
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM312335 |
| SMILES |
NCCC(CN)(CN)CN
|
| InChIKey |
JFFZRBOZJBRBBP-UHFFFAOYSA-N
|
| MW [Da] |
146.24
Automatically obtained from RDkit software. |
| LogP |
-1.8
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM139171
Similarity: 0.9259
Similarity to MM139171
| Tanimoto metric | 0.9259 |
|---|---|
| Cosine metric | 0.9623 |
| Dice metric | 0.9615 |
| MW: | 131.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM319425
Similarity: 0.7576
Similarity to MM319425
| Tanimoto metric | 0.7576 |
|---|---|
| Cosine metric | 0.8641 |
| Dice metric | 0.8621 |
| MW: | 145.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM78275
Similarity: 0.7407
Similarity to MM78275
| Tanimoto metric | 0.7407 |
|---|---|
| Cosine metric | 0.8607 |
| Dice metric | 0.8511 |
| MW: | 116.21 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.32 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+334 more
