Identifier: MM224385
2D Structure
3D Structure
Source:
General | |
Identifier | MM224385 |
SMILES |
CC=C(C#N)CC(C)(C)C
|
InChIKey |
KCKUGAVOAMGNCU-UHFFFAOYSA-N
|
MW [Da] |
137.23
Automatically obtained from RDkit software. |
LogP |
2.89
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM150282
Similarity: 0.8571
Similarity to MM150282
Tanimoto metric | 0.8571 |
---|---|
Cosine metric | 0.9258 |
Dice metric | 0.9231 |
MW: | 123.2 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 2.5 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM273491
Similarity: 0.7156
Similarity to MM273491
Tanimoto metric | 0.7156 |
---|---|
Cosine metric | 0.8345 |
Dice metric | 0.8342 |
MW: | 134.18 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 2.01 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM130182
Similarity: 0.7143
Similarity to MM130182
Tanimoto metric | 0.7143 |
---|---|
Cosine metric | 0.8452 |
Dice metric | 0.8333 |
MW: | 123.2 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 2.5 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+483 more