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DocumentationIdentifier: MM279262
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM279262 |
| SMILES |
N=C(C=CN)NCCCN
|
| InChIKey |
IPANMFMHDRLTQS-UHFFFAOYSA-N
|
| MW [Da] |
142.21
Automatically obtained from RDkit software. |
| LogP |
-0.63
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM357620
Similarity: 0.7642
Similarity to MM357620
| Tanimoto metric | 0.7642 |
|---|---|
| Cosine metric | 0.8664 |
| Dice metric | 0.8663 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.7 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM279263
Similarity: 0.757
Similarity to MM279263
| Tanimoto metric | 0.757 |
|---|---|
| Cosine metric | 0.8619 |
| Dice metric | 0.8617 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.59 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM365593
Similarity: 0.7347
Similarity to MM365593
| Tanimoto metric | 0.7347 |
|---|---|
| Cosine metric | 0.8499 |
| Dice metric | 0.8471 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+371 more
