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DocumentationIdentifier: MM246033
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM246033 |
| SMILES |
CN(C)C(=N)CC(N)CN
|
| InChIKey |
LXEKLCXXQSOMCT-UHFFFAOYSA-N
|
| MW [Da] |
144.22
Automatically obtained from RDkit software. |
| LogP |
-0.8
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM141972
Similarity: 0.7949
Similarity to MM141972
| Tanimoto metric | 0.7949 |
|---|---|
| Cosine metric | 0.8916 |
| Dice metric | 0.8857 |
| MW: | 130.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM246062
Similarity: 0.6741
Similarity to MM246062
| Tanimoto metric | 0.6741 |
|---|---|
| Cosine metric | 0.8058 |
| Dice metric | 0.8053 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM262436
Similarity: 0.6691
Similarity to MM262436
| Tanimoto metric | 0.6691 |
|---|---|
| Cosine metric | 0.8018 |
| Dice metric | 0.8017 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.75 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+403 more
