Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM76795
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM76795 |
| SMILES |
C#CC(C)(C#C)N(C)C=O
|
| InChIKey |
YJAQBHKYUWKNMC-UHFFFAOYSA-N
|
| MW [Da] |
135.17
Automatically obtained from RDkit software. |
| LogP |
0.1
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM42446
Similarity: 0.7273
Similarity to MM42446
| Tanimoto metric | 0.7273 |
|---|---|
| Cosine metric | 0.8528 |
| Dice metric | 0.8421 |
| MW: | 121.14 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.24 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM53347
Similarity: 0.7172
Similarity to MM53347
| Tanimoto metric | 0.7172 |
|---|---|
| Cosine metric | 0.8469 |
| Dice metric | 0.8353 |
| MW: | 121.14 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM78253
Similarity: 0.699
Similarity to MM78253
| Tanimoto metric | 0.699 |
|---|---|
| Cosine metric | 0.8301 |
| Dice metric | 0.8229 |
| MW: | 131.13 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.63 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+220 more
