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DocumentationIdentifier: MM461512
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM461512 |
| SMILES |
CC(N)C(N)CN1CC1
|
| InChIKey |
YRSRNPFZIBTDEA-UHFFFAOYSA-N
|
| MW [Da] |
129.21
Automatically obtained from RDkit software. |
| LogP |
-1.02
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM318802
Similarity: 0.7466
Similarity to MM318802
| Tanimoto metric | 0.7466 |
|---|---|
| Cosine metric | 0.864 |
| Dice metric | 0.8549 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.64 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM120901
Similarity: 0.7064
Similarity to MM120901
| Tanimoto metric | 0.7064 |
|---|---|
| Cosine metric | 0.8405 |
| Dice metric | 0.828 |
| MW: | 114.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM120902
Similarity: 0.6697
Similarity to MM120902
| Tanimoto metric | 0.6697 |
|---|---|
| Cosine metric | 0.8184 |
| Dice metric | 0.8022 |
| MW: | 115.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.41 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+183 more
