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Ligand Download |
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| Ligand Name: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID | ||
| HET ID: MES | PubChem: 4478249, 78165 | |
| DrugBank: DB03814 | ChEMBL: CHEMBL1234276 | |
| Canonical SMILES: [O-]S(=O)(=O)CC[NH+]1CCOCC1 | ||
| Standard InChI: InChI=1S/C6H13NO4S/c8-12(9,10)6-3-7-1-4-11-5-2-7/h1-6H2,(H,8,9,10) | ||
| Molecular Formula: C6H13NO4S | Mol. Weight: 195.23672 | Heavy Atoms: 12 |
| Charge: 0 | Is Chiral: False | logP: 0.0967 |
| HBD: 1 | HBA: 4 | TPSA: 79.25 |
| #Bonds: 13 | #Rotatable Bonds: 3 | Shape Complexity: 1.0 |
| Stereocomplexity: 0.0 | ||
Bound Proteins |
Protein Name | Uniprot ID/ACC | Organism | PDB ID | Binding Affinity | Binding Database | Complex Card |
| Probable strigolactone esterase DAD2 | J9U5U9 (DAD2_PETHY) | Petunia hybrida | 6UH8 |
- |
- |
SHOW |
| Lethal(3)malignant brain tumor-like protein 1 | Q9Y468 (LMBL1_HUMAN) | Homo sapiens | 2RJC |
- |
- |
SHOW |
| Glutamine ABC transporter permease and substrate binding protein protein | Q9CES5 (Q9CES5_LACLA) | Lactococcus lactis | 6H30 |
- |
- |
SHOW |
| Endoplasmic reticulum aminopeptidase 2 | Q6P179 (ERAP2_HUMAN) | Homo sapiens | 6EA4 |
- |
- |
SHOW |
| PHD finger protein 20-like protein 1 | A8MW92 (P20L1_HUMAN) | Homo sapiens | 6L10 |
- |
- |
SHOW |
| ChoE | Q9HUP2 (Q9HUP2_PSEAE) | Pseudomonas aeruginosa | 6UQV |
- |
- |
SHOW |
| Choline kinase | Q8DPI4 (Q8DPI4_STRR6) | Streptococcus pneumoniae | 4R78 |
- |
- |
SHOW |