Identifier: MM19727
2D Structure
3D Structure
Source:
General | |
Identifier | MM19727 |
SMILES |
Fc1ccc(C(CCCNCCCN2CCCCC2)c2ccc(F)cc2)cc1
|
InChIKey |
YHDCQGYFBMAZSX-UHFFFAOYSA-N
|
MW [Da] |
386.53
Automatically obtained from RDkit software. |
LogP |
5.34
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM20647
Similarity: 0.7558
Similarity to MM20647
Tanimoto metric | 0.7558 |
---|---|
Cosine metric | 0.8678 |
Dice metric | 0.8609 |
MW: | 358.43 |
||||
---|---|---|---|---|---|
PI: | 1
Total passive interactions
|
LogP: | 3.83 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM20993
Similarity: 0.7212
Similarity to MM20993
Tanimoto metric | 0.7212 |
---|---|
Cosine metric | 0.843 |
Dice metric | 0.838 |
MW: | 476.61 |
||||
---|---|---|---|---|---|
PI: | 1
Total passive interactions
|
LogP: | 6.04 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM20996
Similarity: 0.6811
Similarity to MM20996
Tanimoto metric | 0.6811 |
---|---|
Cosine metric | 0.8185 |
Dice metric | 0.8103 |
MW: | 480.57 |
||||
---|---|---|---|---|---|
PI: | 1
Total passive interactions
|
LogP: | 5.79 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+28 more