Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM294539
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM294539 |
| SMILES |
C=C(C#CC=CC)C(C)N
|
| InChIKey |
CGHYAPDJBKEURP-UHFFFAOYSA-N
|
| MW [Da] |
135.21
Automatically obtained from RDkit software. |
| LogP |
1.47
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM163683
Similarity: 0.8431
Similarity to MM163683
| Tanimoto metric | 0.8431 |
|---|---|
| Cosine metric | 0.9182 |
| Dice metric | 0.9149 |
| MW: | 121.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM108764
Similarity: 0.7059
Similarity to MM108764
| Tanimoto metric | 0.7059 |
|---|---|
| Cosine metric | 0.8402 |
| Dice metric | 0.8276 |
| MW: | 109.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.91 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM359060
Similarity: 0.696
Similarity to MM359060
| Tanimoto metric | 0.696 |
|---|---|
| Cosine metric | 0.8213 |
| Dice metric | 0.8208 |
| MW: | 133.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+314 more
