Ligand

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Ligand Name:   2-[BIS-(2-HYDROXY-ETHYL)-AMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL
HET ID:   BTB PubChem:   81462
DrugBank:   DB02748 ChEMBL:   CHEMBL1229649
Canonical SMILES:   OCCN(C(CO)(CO)CO)CCO
Standard InChI:   InChI=1S/C8H19NO5/c10-3-1-9(2-4-11)8(5-12,6-13)7-14/h10-14H,1-7H2
Molecular Formula:   C8H19NO5 Mol. Weight:   209.24016 Heavy Atoms:   14
Charge:   0 Is Chiral:   False logP:   -3.0113
HBD:   5 HBA:   6 TPSA:   104.39
#Bonds:   13 #Rotatable Bonds:   8 Shape Complexity:   1.0
Stereocomplexity:   0.0
Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID Binding Affinity Binding Database Complex Card
JIL-1 anchoring and stabilizing protein, isoform A Q9VAA9 (Q9VAA9_DROME) Drosophila melanogaster 6KCU
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Uncharacterized N-acetyltransferase SAMEA2070299_04524 A0A1M9A4M7 (A0A1M9A4M7_9MYCO) Mycobacteroides abscessus 6RFY
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Sucrose 6(F)-phosphate phosphorylase D9TT09 (SUCPP_THETC) Thermoanaerobacterium thermosaccharolyticum 6S9V
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DNA (cytosine-5)-methyltransferase 3B Q9UBC3 (DNM3B_HUMAN) Homo sapiens 3QKJ
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