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DocumentationIdentifier: MM440358
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM440358 |
| SMILES |
C#CC1CN1CC(=O)CC
|
| InChIKey |
RZGFUDFZULGJCY-UHFFFAOYSA-N
|
| MW [Da] |
137.18
Automatically obtained from RDkit software. |
| LogP |
0.28
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM439855
Similarity: 0.8443
Similarity to MM439855
| Tanimoto metric | 0.8443 |
|---|---|
| Cosine metric | 0.9189 |
| Dice metric | 0.9156 |
| MW: | 123.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM184846
Similarity: 0.7066
Similarity to MM184846
| Tanimoto metric | 0.7066 |
|---|---|
| Cosine metric | 0.8406 |
| Dice metric | 0.8281 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM430857
Similarity: 0.65
Similarity to MM430857
| Tanimoto metric | 0.65 |
|---|---|
| Cosine metric | 0.7904 |
| Dice metric | 0.7879 |
| MW: | 137.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+21 more
