Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM237797
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM237797 |
| SMILES |
C=C(C)NC(=N)C#CCN
|
| InChIKey |
APUZFLJJXNWQOX-UHFFFAOYSA-N
|
| MW [Da] |
137.19
Automatically obtained from RDkit software. |
| LogP |
0.05
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM135945
Similarity: 0.8889
Similarity to MM135945
| Tanimoto metric | 0.8889 |
|---|---|
| Cosine metric | 0.9428 |
| Dice metric | 0.9412 |
| MW: | 122.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM264903
Similarity: 0.75
Similarity to MM264903
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.8577 |
| Dice metric | 0.8571 |
| MW: | 132.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.72 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM237798
Similarity: 0.7385
Similarity to MM237798
| Tanimoto metric | 0.7385 |
|---|---|
| Cosine metric | 0.8504 |
| Dice metric | 0.8496 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+144 more
