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DocumentationIdentifier: MM233761
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM233761 |
| SMILES |
CCNCC(C)(N)CNC
|
| InChIKey |
FIPFBPMQAWEVHE-UHFFFAOYSA-N
|
| MW [Da] |
145.25
Automatically obtained from RDkit software. |
| LogP |
-0.47
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM138144
Similarity: 0.8974
Similarity to MM138144
| Tanimoto metric | 0.8974 |
|---|---|
| Cosine metric | 0.9473 |
| Dice metric | 0.9459 |
| MW: | 131.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM307809
Similarity: 0.8537
Similarity to MM307809
| Tanimoto metric | 0.8537 |
|---|---|
| Cosine metric | 0.9214 |
| Dice metric | 0.9211 |
| MW: | 146.24 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.79 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM227786
Similarity: 0.7692
Similarity to MM227786
| Tanimoto metric | 0.7692 |
|---|---|
| Cosine metric | 0.87 |
| Dice metric | 0.8696 |
| MW: | 145.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+331 more
