Identifier: MM172353
2D Structure
3D Structure
Source:
General | |
Identifier | MM172353 |
SMILES |
C=C(CF)C(O)CNC
|
InChIKey |
WAYRLXNIIYHFFF-UHFFFAOYSA-N
|
MW [Da] |
133.17
Automatically obtained from RDkit software. |
LogP |
0.09
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM53559
Similarity: 0.8421
Similarity to MM53559
Tanimoto metric | 0.8421 |
---|---|
Cosine metric | 0.9177 |
Dice metric | 0.9143 |
MW: | 147.19 |
||||
---|---|---|---|---|---|
PI: | 1
Total passive interactions
|
LogP: | 0.43 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM111711
Similarity: 0.7589
Similarity to MM111711
Tanimoto metric | 0.7589 |
---|---|
Cosine metric | 0.8712 |
Dice metric | 0.8629 |
MW: | 119.14 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | -0.17 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM75219
Similarity: 0.6786
Similarity to MM75219
Tanimoto metric | 0.6786 |
---|---|
Cosine metric | 0.8238 |
Dice metric | 0.8085 |
MW: | 115.18 |
||||
---|---|---|---|---|---|
PI: | 1
Total passive interactions
|
LogP: | 0.14 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+419 more