dATPαS

Ligand id: 1715

Name: dATPαS

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 16
Hydrogen bond donors 6
Rotatable bonds 8
Topological polar surface area 303.35
Molecular weight 506.98
XLogP -3.37
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

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Similar Ligands
Ap3a
[3H]cAMP
Targets
protein kinase A
cyclic AMP
Targets
CNGA1; CNGA2; CNGA3; HCN1; HCN2; HCN4; OATP4C1; phosphodiesterase 11A; phosphodiesterase 1C; phosphodiesterase 4A; phosphodiesterase 4D; phosphodiesterase 5A; phosphodiesterase 7A; phosphodiesterase 7B; phosphodiesterase 8B... click on ligand to see complete list
Rp-cAMPS
Targets
protein kinase A
[35S]ATPαS
ATP
Targets
KNa1.2; Kir6.1; P2X1; P2X2; P2X3; P2X4; P2X5; P2X6; P2X7; P2Y11 receptor; P2Y13 receptor; P2Y1 receptor; P2Y2 receptor; P2Y4 receptor; diphosphomevalonate decarboxylase... click on ligand to see complete list
ADP ribose
Targets
TRPM2
[35S]ADPβS
Targets
P2Y1 receptor
ADPβS
Targets
P2Y11 receptor; P2Y12 receptor; P2Y13 receptor; P2Y1 receptor
adenosine diphosphate
Targets
P2Y12 receptor; P2Y13 receptor; P2Y1 receptor; P2Y6 receptor; Peroxisomal membrane protein; SLC25A42; TRPM4; phosphomevalonate kinase
AMP-PNP
Targets
TRPM4
vidarabine
Targets
Equilibrative nucleoside transporter 1; Equilibrative nucleoside transporter 2; Sodium/nucleoside cotransporter 2
adenosine
Targets
A1 receptor; A2A receptor; A2B receptor; A3 receptor; Adenosine deaminase; Adenosine kinase; Equilibrative nucleoside transporter 1; Equilibrative nucleoside transporter 2; Equilibrative nucleoside transporter 3; Plasma membrane monoamine transporter; Sodium/nucleoside cotransporter 1; Sodium/nucleoside cotransporter 2; TRPM4; phosphatidylinositol 4-kinase type 2 alpha; phosphatidylinositol 4-kinase type 2 beta... click on ligand to see complete list
L-βγ-meATP
Targets
P2X1
OAADPR
Targets
TRPM2
A3P5PS
Targets
PAPS transporter 1; PAPS transporter 2
AMA
Targets
Histidine decarboxylase
2-chloroadenosine-5-triphosphate
Targets
P2Y1 receptor
cordycepin
Targets
Equilibrative nucleoside transporter 3
[35S]dATPαS
dATP
Targets
P2Y11 receptor
N6 benzyl-cAMP
Targets
protein kinase A
Ap4A
Targets
P2Y13 receptor; P2Y2 receptor; P2Y4 receptor
αβ-methyleneADP
Targets
Ecto-5'-Nucleotidase
DS-437
Targets
protein arginine methyltransferase 5 ; protein arginine methyltransferase 7
S-adenosyl methionine
Targets
S-Adenosylmethionine carrier; S-Adenosylmethionine decarboxylase
adenosine-3'-5'-bisphosphate
Targets
P2Y1 receptor
ATPγS
Targets
P2Y11 receptor; P2Y13 receptor; P2Y1 receptor
[35S]ATPγS
NAD
Targets
P2Y11 receptor; TRPM2
flavin adenine dinucleotide
2'-deoxyadenosine
Targets
Adenosine deaminase
S-adenosyl-L-methioninamine
adenophostin A
Targets
IP3R1; IP3R2
2',3'-ddATP
Targets
P2Y1 receptor
BzATP
Targets
P2X1; P2X3; P2Y11 receptor