Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM243891
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM243891 |
| SMILES |
C=C(C)C(C)(CC)CC#N
|
| InChIKey |
QVTXAUMTCPUOTF-UHFFFAOYSA-N
|
| MW [Da] |
137.23
Automatically obtained from RDkit software. |
| LogP |
2.89
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM132721
Similarity: 0.8556
Similarity to MM132721
| Tanimoto metric | 0.8556 |
|---|---|
| Cosine metric | 0.925 |
| Dice metric | 0.9222 |
| MW: | 123.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM312585
Similarity: 0.7889
Similarity to MM312585
| Tanimoto metric | 0.7889 |
|---|---|
| Cosine metric | 0.8882 |
| Dice metric | 0.882 |
| MW: | 137.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM244035
Similarity: 0.7545
Similarity to MM244035
| Tanimoto metric | 0.7545 |
|---|---|
| Cosine metric | 0.8621 |
| Dice metric | 0.8601 |
| MW: | 135.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+499 more
