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DocumentationH-ala-ser-oh
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM467743 |
| SMILES |
CC(N)C(=O)NC(CO)C(=O)O
|
| InChIKey |
IPWKGIFRRBGCJO-UHFFFAOYSA-N
|
| MW [Da] |
176.17
Automatically obtained from RDkit software. |
| LogP |
-2.1
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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Similarity: 0.9071
Similarity to H-ser-ser-oh
| Tanimoto metric | 0.9071 |
|---|---|
| Cosine metric | 0.9524 |
| Dice metric | 0.9513 |
| MW: | 192.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
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| LogP: | -3.13 |
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| AI: | 0
Total active interactions
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| Tanimoto metric | 0.8829 |
|---|---|
| Cosine metric | 0.9396 |
| Dice metric | 0.9378 |
| MW: | 160.17 |
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|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
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| LogP: | -1.08 |
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| AI: | 0
Total active interactions
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Similarity: 0.8142
Similarity to H-ser-ala-oh
| Tanimoto metric | 0.8142 |
|---|---|
| Cosine metric | 0.8976 |
| Dice metric | 0.8976 |
| MW: | 176.17 |
||||
|---|---|---|---|---|---|
| PI: | 0
Total passive interactions
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| LogP: | -2.1 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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+79 more
