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DocumentationIdentifier: MM346448
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM346448 |
| SMILES |
O=CCCN1CC1
|
| InChIKey |
VMXQFFOJFFWWNS-UHFFFAOYSA-N
|
| MW [Da] |
99.13
Automatically obtained from RDkit software. |
| LogP |
-0.11
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM353284
Similarity: 0.7042
Similarity to MM353284
| Tanimoto metric | 0.7042 |
|---|---|
| Cosine metric | 0.8392 |
| Dice metric | 0.8264 |
| MW: | 113.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM432775
Similarity: 0.6944
Similarity to MM432775
| Tanimoto metric | 0.6944 |
|---|---|
| Cosine metric | 0.8333 |
| Dice metric | 0.8197 |
| MW: | 113.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM346480
Similarity: 0.6667
Similarity to MM346480
| Tanimoto metric | 0.6667 |
|---|---|
| Cosine metric | 0.8165 |
| Dice metric | 0.8 |
| MW: | 113.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+77 more
