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DocumentationIdentifier: MM307793
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM307793 |
| SMILES |
COC(C)(CN)CCCO
|
| InChIKey |
VNHPSFNSCZIJRF-UHFFFAOYSA-N
|
| MW [Da] |
147.22
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
MM239226
Similarity: 0.7373
Similarity to MM239226
| Tanimoto metric | 0.7373 |
|---|---|
| Cosine metric | 0.8511 |
| Dice metric | 0.8488 |
| MW: | 147.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM228972
Similarity: 0.7244
Similarity to MM228972
| Tanimoto metric | 0.7244 |
|---|---|
| Cosine metric | 0.8402 |
| Dice metric | 0.8402 |
| MW: | 145.25 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM138086
Similarity: 0.7091
Similarity to MM138086
| Tanimoto metric | 0.7091 |
|---|---|
| Cosine metric | 0.8421 |
| Dice metric | 0.8298 |
| MW: | 133.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.53 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+253 more
