daminozide

Ligand id: 7025

Name: daminozide

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 5
Topological polar surface area 69.64
Molecular weight 160.08
XLogP -1.14
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

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Similar Ligands
L-lactic acid
Targets
HCA1 receptor; Monocarboxylate transporter 1; Monocarboxylate transporter 2; Monocarboxylate transporter 3; Monocarboxylate transporter 4; SMCT1; SMCT2; Sialin
D-lactic acid
Targets
HCA1 receptor; SMCT1
[3H]alanine
Targets
sodium-coupled neutral amino acid transporter 1; sodium-coupled neutral amino acid transporter 2; sodium-coupled neutral amino acid transporter 4
[14C]alanine
Targets
sodium-coupled neutral amino acid transporter 1; sodium-coupled neutral amino acid transporter 2; sodium-coupled neutral amino acid transporter 4
L-alanine
Targets
Alanine/serine/cysteine transporter 1; Alanine/serine/cysteine transporter 2; B0AT1; B0AT2; B0AT3; CaS receptor; GPRC6 receptor; NTT4; Proton-coupled Amino acid Transporter 1; Proton-coupled Amino acid Transporter 2; Sodium-coupled neutral amino acid transporter 3; Sodium-coupled neutral amino acid transporter 5; sodium-coupled neutral amino acid transporter 1; sodium-coupled neutral amino acid transporter 2; sodium-coupled neutral amino acid transporter 4
D-alanine
Targets
Proton-coupled Amino acid Transporter 1
β-D-hydroxybutyric acid
Targets
HCA2 receptor; Monocarboxylate transporter 1; SMCT1
β-L-hydroxybutyric acid
Targets
SMCT1
L-valine
Targets
ATB0,+; Alanine/serine/cysteine transporter 2; B0AT1; B0AT2; L-type amino acid transporter 3; L-type amino acid transporter 4; sodium-coupled neutral amino acid transporter 1
L-leucine
Targets
ATB0,+; Alanine/serine/cysteine transporter 2; B0AT1; B0AT2; B0AT3; L-type amino acid transporter 3; L-type amino acid transporter 4; NTT4; sodium-coupled neutral amino acid transporter 2; sodium-coupled neutral amino acid transporter 4
acetic acid
Targets
FFA2 receptor; FFA3 receptor; SMCT1
malic acid
Targets
Mitochondrial citrate transporter; Mitochondrial dicarboxylate transporter; Mitochondrial oxoglutarate carrier; TRPP2
L-isoleucine
Targets
ATB0,+; B0AT1; B0AT2; L-type amino acid transporter 3; L-type amino acid transporter 4
foscarnet
pyruvic acid
Targets
Monocarboxylate transporter 1; Monocarboxylate transporter 2; Monocarboxylate transporter 4; Na+/citrate cotransporter; Pyruvate carboxylase; SMCT1; SMCT2
penicillamine
L-threonine
Targets
Alanine/serine/cysteine transporter 1; Alanine/serine/cysteine transporter 2; B0AT1; B0AT2; sodium-coupled neutral amino acid transporter 1; sodium-coupled neutral amino acid transporter 2
aminooxyacetic acid
Targets
Cystathionine β-synthase; Cystathionine γ-lyase
MTSEA
Targets
TRPA1
3-mercaptopyruvic acid
Targets
3-Mercaptopyruvate sulfurtransferase
lesogaberan
Targets
GABAB1
acamprosate
creatine
Targets
CT1; MATE2; Multidrug and toxin extrusion