Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM442446
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM442446 |
| SMILES |
C#CCN1CC1C#CC=C
|
| InChIKey |
CEEUKYWCFDWWON-UHFFFAOYSA-N
|
| MW [Da] |
131.18
Automatically obtained from RDkit software. |
| LogP |
0.49
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM217340
Similarity: 0.8912
Similarity to MM217340
| Tanimoto metric | 0.8912 |
|---|---|
| Cosine metric | 0.944 |
| Dice metric | 0.9424 |
| MW: | 121.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.88 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM194961
Similarity: 0.8299
Similarity to MM194961
| Tanimoto metric | 0.8299 |
|---|---|
| Cosine metric | 0.911 |
| Dice metric | 0.9071 |
| MW: | 119.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM441266
Similarity: 0.8079
Similarity to MM441266
| Tanimoto metric | 0.8079 |
|---|---|
| Cosine metric | 0.8964 |
| Dice metric | 0.8938 |
| MW: | 133.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.72 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+260 more
