Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM209301
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM209301 |
| SMILES |
NCC(N)C=CC1CN1
|
| InChIKey |
GBMXGODABNSPNU-UHFFFAOYSA-N
|
| MW [Da] |
127.19
Automatically obtained from RDkit software. |
| LogP |
-1.2
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM121276
Similarity: 0.8276
Similarity to MM121276
| Tanimoto metric | 0.8276 |
|---|---|
| Cosine metric | 0.9097 |
| Dice metric | 0.9057 |
| MW: | 112.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM455783
Similarity: 0.8131
Similarity to MM455783
| Tanimoto metric | 0.8131 |
|---|---|
| Cosine metric | 0.9017 |
| Dice metric | 0.8969 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.94 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM209306
Similarity: 0.7374
Similarity to MM209306
| Tanimoto metric | 0.7374 |
|---|---|
| Cosine metric | 0.8489 |
| Dice metric | 0.8488 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+166 more
