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DocumentationIdentifier: MM340666
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM340666 |
| SMILES |
N=C(N)CNC(CN)CN
|
| InChIKey |
ZNCPGVKYVDJWSO-UHFFFAOYSA-N
|
| MW [Da] |
145.21
Automatically obtained from RDkit software. |
| LogP |
-2.2
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM144360
Similarity: 0.9067
Similarity to MM144360
| Tanimoto metric | 0.9067 |
|---|---|
| Cosine metric | 0.9522 |
| Dice metric | 0.951 |
| MW: | 130.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM228073
Similarity: 0.7419
Similarity to MM228073
| Tanimoto metric | 0.7419 |
|---|---|
| Cosine metric | 0.8542 |
| Dice metric | 0.8519 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.75 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM245251
Similarity: 0.7083
Similarity to MM245251
| Tanimoto metric | 0.7083 |
|---|---|
| Cosine metric | 0.8323 |
| Dice metric | 0.8293 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.75 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+183 more
