Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM174568
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM174568 |
| SMILES |
CC#CC(F)C(C)CO
|
| InChIKey |
LMHHLBIVHBYNNK-UHFFFAOYSA-N
|
| MW [Da] |
130.16
Automatically obtained from RDkit software. |
| LogP |
0.98
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM357508
Similarity: 0.8922
Similarity to MM357508
| Tanimoto metric | 0.8922 |
|---|---|
| Cosine metric | 0.9445 |
| Dice metric | 0.943 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM357662
Similarity: 0.8125
Similarity to MM357662
| Tanimoto metric | 0.8125 |
|---|---|
| Cosine metric | 0.9014 |
| Dice metric | 0.8966 |
| MW: | 141.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM111605
Similarity: 0.7582
Similarity to MM111605
| Tanimoto metric | 0.7582 |
|---|---|
| Cosine metric | 0.8708 |
| Dice metric | 0.8625 |
| MW: | 116.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.59 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+579 more
