Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM426563
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM426563 |
| SMILES |
C#CC(C#C)C1NC1CN
|
| InChIKey |
ARGDHEZFBOBCCC-UHFFFAOYSA-N
|
| MW [Da] |
134.18
Automatically obtained from RDkit software. |
| LogP |
-0.83
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM210762
Similarity: 0.9226
Similarity to MM210762
| Tanimoto metric | 0.9226 |
|---|---|
| Cosine metric | 0.9605 |
| Dice metric | 0.9598 |
| MW: | 124.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM435570
Similarity: 0.799
Similarity to MM435570
| Tanimoto metric | 0.799 |
|---|---|
| Cosine metric | 0.8889 |
| Dice metric | 0.8883 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.18 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM443997
Similarity: 0.7598
Similarity to MM443997
| Tanimoto metric | 0.7598 |
|---|---|
| Cosine metric | 0.8653 |
| Dice metric | 0.8635 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+84 more
