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DocumentationIdentifier: MM375689
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM375689 |
| SMILES |
CCC(CNC)C(N)CN
|
| InChIKey |
KIUYJHJVJDIWJE-UHFFFAOYSA-N
|
| MW [Da] |
145.25
Automatically obtained from RDkit software. |
| LogP |
-0.48
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM304934
Similarity: 0.8241
Similarity to MM304934
| Tanimoto metric | 0.8241 |
|---|---|
| Cosine metric | 0.9041 |
| Dice metric | 0.9036 |
| MW: | 145.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM171811
Similarity: 0.7451
Similarity to MM171811
| Tanimoto metric | 0.7451 |
|---|---|
| Cosine metric | 0.8632 |
| Dice metric | 0.8539 |
| MW: | 131.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM95692
Similarity: 0.7244
Similarity to MM95692
| Tanimoto metric | 0.7244 |
|---|---|
| Cosine metric | 0.8422 |
| Dice metric | 0.8402 |
| MW: | 145.25 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+314 more
