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DocumentationIdentifier: MM380982
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM380982 |
| SMILES |
NCC(=CCF)CCCF
|
| InChIKey |
ZUVSJPPVOZIQID-UHFFFAOYSA-N
|
| MW [Da] |
149.18
Automatically obtained from RDkit software. |
| LogP |
1.59
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM199739
Similarity: 0.8163
Similarity to MM199739
| Tanimoto metric | 0.8163 |
|---|---|
| Cosine metric | 0.9035 |
| Dice metric | 0.8989 |
| MW: | 131.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.64 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM380980
Similarity: 0.7321
Similarity to MM380980
| Tanimoto metric | 0.7321 |
|---|---|
| Cosine metric | 0.8454 |
| Dice metric | 0.8454 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.58 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM274324
Similarity: 0.7069
Similarity to MM274324
| Tanimoto metric | 0.7069 |
|---|---|
| Cosine metric | 0.8283 |
| Dice metric | 0.8283 |
| MW: | 149.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.94 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+748 more
