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DocumentationIdentifier: MM308005
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM308005 |
| SMILES |
N=CNCC(N)(CN)CN
|
| InChIKey |
NSTCHZZWRAHFBB-UHFFFAOYSA-N
|
| MW [Da] |
145.21
Automatically obtained from RDkit software. |
| LogP |
-2.2
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM240002
Similarity: 0.7835
Similarity to MM240002
| Tanimoto metric | 0.7835 |
|---|---|
| Cosine metric | 0.8804 |
| Dice metric | 0.8786 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM139213
Similarity: 0.7037
Similarity to MM139213
| Tanimoto metric | 0.7037 |
|---|---|
| Cosine metric | 0.8389 |
| Dice metric | 0.8261 |
| MW: | 132.21 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -2.18 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM102756
Similarity: 0.6667
Similarity to MM102756
| Tanimoto metric | 0.6667 |
|---|---|
| Cosine metric | 0.8165 |
| Dice metric | 0.8 |
| MW: | 115.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+313 more
