Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM440605
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM440605 |
| SMILES |
CC#CC(C)C1NC1C=O
|
| InChIKey |
IYWPOUVDZCTYHZ-UHFFFAOYSA-N
|
| MW [Da] |
137.18
Automatically obtained from RDkit software. |
| LogP |
0.19
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM438818
Similarity: 0.8141
Similarity to MM438818
| Tanimoto metric | 0.8141 |
|---|---|
| Cosine metric | 0.9023 |
| Dice metric | 0.8975 |
| MW: | 123.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM435374
Similarity: 0.6762
Similarity to MM435374
| Tanimoto metric | 0.6762 |
|---|---|
| Cosine metric | 0.8071 |
| Dice metric | 0.8068 |
| MW: | 137.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.19 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM444092
Similarity: 0.6696
Similarity to MM444092
| Tanimoto metric | 0.6696 |
|---|---|
| Cosine metric | 0.8031 |
| Dice metric | 0.8021 |
| MW: | 133.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.62 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+117 more
