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DocumentationIdentifier: MM254653
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM254653 |
| SMILES |
CC(C)CCC(C)C(=N)N
|
| InChIKey |
NETVTPZTFVPQPI-UHFFFAOYSA-N
|
| MW [Da] |
142.25
Automatically obtained from RDkit software. |
| LogP |
1.99
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM162123
Similarity: 0.9375
Similarity to MM162123
| Tanimoto metric | 0.9375 |
|---|---|
| Cosine metric | 0.9682 |
| Dice metric | 0.9677 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.75 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM301920
Similarity: 0.7813
Similarity to MM301920
| Tanimoto metric | 0.7813 |
|---|---|
| Cosine metric | 0.879 |
| Dice metric | 0.8772 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.36 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM301636
Similarity: 0.7813
Similarity to MM301636
| Tanimoto metric | 0.7813 |
|---|---|
| Cosine metric | 0.879 |
| Dice metric | 0.8772 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.91 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+497 more
