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DocumentationIdentifier: MM362733
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM362733 |
| SMILES |
NCCCCCC(N)CO
|
| InChIKey |
MNCGDMBLXGJKOB-UHFFFAOYSA-N
|
| MW [Da] |
146.23
Automatically obtained from RDkit software. |
| LogP |
-0.17
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM165457
Similarity: 0.9344
Similarity to MM165457
| Tanimoto metric | 0.9344 |
|---|---|
| Cosine metric | 0.9667 |
| Dice metric | 0.9661 |
| MW: | 131.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM362735
Similarity: 0.9048
Similarity to MM362735
| Tanimoto metric | 0.9048 |
|---|---|
| Cosine metric | 0.9501 |
| Dice metric | 0.95 |
| MW: | 147.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM257540
Similarity: 0.8507
Similarity to MM257540
| Tanimoto metric | 0.8507 |
|---|---|
| Cosine metric | 0.9195 |
| Dice metric | 0.9194 |
| MW: | 146.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.18 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+536 more
