Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM363881
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM363881 |
| SMILES |
C#CCCN=CN(C)C=C
|
| InChIKey |
CHKUNXIRYHTQBG-UHFFFAOYSA-N
|
| MW [Da] |
136.2
Automatically obtained from RDkit software. |
| LogP |
1.11
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM169649
Similarity: 0.8228
Similarity to MM169649
| Tanimoto metric | 0.8228 |
|---|---|
| Cosine metric | 0.9071 |
| Dice metric | 0.9028 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM425787
Similarity: 0.7471
Similarity to MM425787
| Tanimoto metric | 0.7471 |
|---|---|
| Cosine metric | 0.8559 |
| Dice metric | 0.8553 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM363585
Similarity: 0.7386
Similarity to MM363585
| Tanimoto metric | 0.7386 |
|---|---|
| Cosine metric | 0.8501 |
| Dice metric | 0.8497 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+256 more
