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DocumentationIdentifier: MM139213
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM139213 |
| SMILES |
CNCC(N)(CN)CN
|
| InChIKey |
ZVIBIXOTJLZBHW-UHFFFAOYSA-N
|
| MW [Da] |
132.21
Automatically obtained from RDkit software. |
| LogP |
-2.18
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM102962
Similarity: 0.9123
Similarity to MM102962
| Tanimoto metric | 0.9123 |
|---|---|
| Cosine metric | 0.9551 |
| Dice metric | 0.9541 |
| MW: | 117.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM307809
Similarity: 0.7703
Similarity to MM307809
| Tanimoto metric | 0.7703 |
|---|---|
| Cosine metric | 0.8777 |
| Dice metric | 0.8702 |
| MW: | 146.24 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.79 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM228998
Similarity: 0.7403
Similarity to MM228998
| Tanimoto metric | 0.7403 |
|---|---|
| Cosine metric | 0.8604 |
| Dice metric | 0.8507 |
| MW: | 146.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.84 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+348 more
