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DocumentationIdentifier: MM447169
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM447169 |
| SMILES |
N#CCOCOCCCO
|
| InChIKey |
QAXISXGVXXQNPD-UHFFFAOYSA-N
|
| MW [Da] |
145.16
Automatically obtained from RDkit software. |
| LogP |
-0.12
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM55928
Similarity: 0.75
Similarity to MM55928
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.866 |
| Dice metric | 0.8571 |
| MW: | 134.18 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.38 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM447389
Similarity: 0.7273
Similarity to MM447389
| Tanimoto metric | 0.7273 |
|---|---|
| Cosine metric | 0.8422 |
| Dice metric | 0.8421 |
| MW: | 140.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.41 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM447468
Similarity: 0.6857
Similarity to MM447468
| Tanimoto metric | 0.6857 |
|---|---|
| Cosine metric | 0.8146 |
| Dice metric | 0.8136 |
| MW: | 139.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+311 more
