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Ligand

NameDSSTox_CID_27783
Molecular formulaC16H23NO15
IUPAC name4-[(1R)-2-amino-1-hydroxyethyl]benzene-1,2-diol;2,3-dihydroxybutanedioic acid
Molecular weight469.352
Hydrogen bond acceptor16
Hydrogen bond donor12
XlogPNone
SynonymsDSSTox_RID_82559
CAS-69815-49-2
Tox21_111640
DTXSID2047806
Tox21_111640_1
[ Show all ]
Inchi KeyACFZEFCGESJKJH-JZGIKJSDSA-N
Inchi IDInChI=1S/C8H11NO3.2C4H6O6/c9-4-8(12)5-1-2-6(10)7(11)3-5;2*5-1(3(7)8)2(6)4(9)10/h1-3,8,10-12H,4,9H2;2*1-2,5-6H,(H,7,8)(H,9,10)/t8-;;/m0../s1
PubChem CID12305037
ChEMBLCHEMBL2130595
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 5 hydrogen bond donor.
This ligand has more than 10 hydrogen bond acceptor.
Partition coefficient log P of this ligand is not available.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
463143Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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