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DocumentationIdentifier: MM352966
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM352966 |
| SMILES |
C=C(CO)C(N)CC=CF
|
| InChIKey |
OKCVIBUPMVBQPL-UHFFFAOYSA-N
|
| MW [Da] |
145.18
Automatically obtained from RDkit software. |
| LogP |
0.74
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM65213
Similarity: 0.7869
Similarity to MM65213
| Tanimoto metric | 0.7869 |
|---|---|
| Cosine metric | 0.8871 |
| Dice metric | 0.8807 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.44 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM162853
Similarity: 0.6967
Similarity to MM162853
| Tanimoto metric | 0.6967 |
|---|---|
| Cosine metric | 0.8347 |
| Dice metric | 0.8213 |
| MW: | 129.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.76 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM352964
Similarity: 0.6761
Similarity to MM352964
| Tanimoto metric | 0.6761 |
|---|---|
| Cosine metric | 0.807 |
| Dice metric | 0.8067 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.83 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+334 more
