Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM244746
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM244746 |
| SMILES |
CC(C)C(C)CC(F)C#N
|
| InChIKey |
VRBIRXMHHLTEGT-UHFFFAOYSA-N
|
| MW [Da] |
143.21
Automatically obtained from RDkit software. |
| LogP |
2.53
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM141627
Similarity: 0.8315
Similarity to MM141627
| Tanimoto metric | 0.8315 |
|---|---|
| Cosine metric | 0.9118 |
| Dice metric | 0.908 |
| MW: | 129.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM326151
Similarity: 0.7789
Similarity to MM326151
| Tanimoto metric | 0.7789 |
|---|---|
| Cosine metric | 0.877 |
| Dice metric | 0.8757 |
| MW: | 143.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM144126
Similarity: 0.7191
Similarity to MM144126
| Tanimoto metric | 0.7191 |
|---|---|
| Cosine metric | 0.848 |
| Dice metric | 0.8366 |
| MW: | 129.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+261 more
