Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM358661
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM358661 |
| SMILES |
C#CC(=O)C(C)C#CC=C
|
| InChIKey |
CYPHRLLPFYODTP-UHFFFAOYSA-N
|
| MW [Da] |
132.16
Automatically obtained from RDkit software. |
| LogP |
1.01
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM174660
Similarity: 0.7905
Similarity to MM174660
| Tanimoto metric | 0.7905 |
|---|---|
| Cosine metric | 0.8891 |
| Dice metric | 0.883 |
| MW: | 120.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.85 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM163603
Similarity: 0.781
Similarity to MM163603
| Tanimoto metric | 0.781 |
|---|---|
| Cosine metric | 0.8837 |
| Dice metric | 0.877 |
| MW: | 122.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM295808
Similarity: 0.7217
Similarity to MM295808
| Tanimoto metric | 0.7217 |
|---|---|
| Cosine metric | 0.8399 |
| Dice metric | 0.8384 |
| MW: | 134.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.24 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+164 more
