|
Analogs
-
5855933
-
-
34599078
-
-
1481864
-
-
2008786
-
-
3872987
-
Draw
Identity
99%
90%
80%
70%
Vendors
And 9 More
Clustered Target Annotations
Code |
Organism Class |
Affinity (nM) |
LE (kcal/mol/atom) |
Type |
AA3R-6-E |
Adenosine Receptor A3 (cluster #6 Of 6), Eukaryotic |
Eukaryotes |
77 |
0.66 |
Binding ≤ 10μM
|
GRIA1-3-E |
Glutamate Receptor Ionotropic, AMPA 1 (cluster #3 Of 4), Eukaryotic |
Eukaryotes |
7500 |
0.48 |
Binding ≤ 10μM
|
GRIA2-3-E |
Glutamate Receptor Ionotropic, AMPA 2 (cluster #3 Of 4), Eukaryotic |
Eukaryotes |
6000 |
0.49 |
Binding ≤ 10μM
|
GRIA3-3-E |
Glutamate Receptor Ionotropic, AMPA 3 (cluster #3 Of 4), Eukaryotic |
Eukaryotes |
6000 |
0.49 |
Binding ≤ 10μM
|
GRIA4-3-E |
Glutamate Receptor Ionotropic, AMPA 4 (cluster #3 Of 5), Eukaryotic |
Eukaryotes |
1714 |
0.54 |
Binding ≤ 10μM
|
GRIK1-3-E |
Glutamate Receptor Ionotropic Kainate 1 (cluster #3 Of 3), Eukaryotic |
Eukaryotes |
177 |
0.63 |
Binding ≤ 10μM
|
GRIK2-2-E |
Glutamate Receptor Ionotropic Kainate 2 (cluster #2 Of 3), Eukaryotic |
Eukaryotes |
53 |
0.68 |
Binding ≤ 10μM
|
GRIK3-2-E |
Glutamate Receptor Ionotropic Kainate 3 (cluster #2 Of 3), Eukaryotic |
Eukaryotes |
10 |
0.75 |
Binding ≤ 10μM
|
GRIK4-2-E |
Glutamate Receptor Ionotropic Kainate 4 (cluster #2 Of 2), Eukaryotic |
Eukaryotes |
7 |
0.76 |
Binding ≤ 10μM
|
GRIK5-2-E |
Glutamate Receptor Ionotropic Kainate 5 (cluster #2 Of 2), Eukaryotic |
Eukaryotes |
7 |
0.76 |
Binding ≤ 10μM
|
GRIA1-3-E |
Glutamate Receptor Ionotropic, AMPA 1 (cluster #3 Of 3), Eukaryotic |
Eukaryotes |
7510 |
0.48 |
Functional ≤ 10μM
|
GRIK2-2-E |
Glutamate Receptor Ionotropic Kainate 2 (cluster #2 Of 2), Eukaryotic |
Eukaryotes |
700 |
0.57 |
Functional ≤ 10μM
|
Z50597-4-O |
Rattus Norvegicus (cluster #4 Of 5), Other |
Other |
18 |
0.72 |
Binding ≤ 10μM
|
Z50466-5-O |
Trypanosoma Cruzi (cluster #5 Of 8), Other |
Other |
3000 |
0.52 |
Functional ≤ 10μM
|
Z50597-6-O |
Rattus Norvegicus (cluster #6 Of 12), Other |
Other |
3700 |
0.51 |
Functional ≤ 10μM
|
Physical Representations
Type
pH range
|
xlogP
|
Des A‑Pol
Apolar desolvation
(kcal/mol)
|
Des Pol
Polar desolvation
(kcal/mol)
|
H Don
H-bond donors
|
H Acc
H-bond acceptors
|
Chg
Net charge
|
tPSA
(Ų)
|
MWT
Molecular weight
(g/mol)
|
RB
Rotatable bonds
|
DL |
Ref
Reference (pH 7)
|
-0.81 |
5.21 |
-88.22 |
2 |
5 |
-1 |
97 |
212.225 |
4 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Vendors
And 145 More
Clustered Target Annotations
Code |
Organism Class |
Affinity (nM) |
LE (kcal/mol/atom) |
Type |
AA3R-6-E |
Adenosine Receptor A3 (cluster #6 Of 6), Eukaryotic |
Eukaryotes |
613 |
0.87 |
Binding ≤ 10μM
|
EAA3-2-E |
Excitatory Amino Acid Transporter 3 (cluster #2 Of 2), Eukaryotic |
Eukaryotes |
51 |
1.02 |
Binding ≤ 10μM
|
GRIA1-3-E |
Glutamate Receptor Ionotropic, AMPA 1 (cluster #3 Of 4), Eukaryotic |
Eukaryotes |
1360 |
0.82 |
Binding ≤ 10μM
|
GRIA2-3-E |
Glutamate Receptor Ionotropic, AMPA 2 (cluster #3 Of 4), Eukaryotic |
Eukaryotes |
940 |
0.84 |
Binding ≤ 10μM
|
GRIA3-3-E |
Glutamate Receptor Ionotropic, AMPA 3 (cluster #3 Of 4), Eukaryotic |
Eukaryotes |
500 |
0.88 |
Binding ≤ 10μM
|
GRIA4-3-E |
Glutamate Receptor Ionotropic, AMPA 4 (cluster #3 Of 5), Eukaryotic |
Eukaryotes |
868 |
0.85 |
Binding ≤ 10μM
|
GRIK1-3-E |
Glutamate Receptor Ionotropic Kainate 1 (cluster #3 Of 3), Eukaryotic |
Eukaryotes |
701 |
0.86 |
Binding ≤ 10μM
|
GRIK2-2-E |
Glutamate Receptor Ionotropic Kainate 2 (cluster #2 Of 3), Eukaryotic |
Eukaryotes |
1106 |
0.83 |
Binding ≤ 10μM
|
GRIK3-2-E |
Glutamate Receptor Ionotropic Kainate 3 (cluster #2 Of 3), Eukaryotic |
Eukaryotes |
789 |
0.85 |
Binding ≤ 10μM
|
GRIK4-2-E |
Glutamate Receptor Ionotropic Kainate 4 (cluster #2 Of 2), Eukaryotic |
Eukaryotes |
700 |
0.86 |
Binding ≤ 10μM
|
GRIK5-2-E |
Glutamate Receptor Ionotropic Kainate 5 (cluster #2 Of 2), Eukaryotic |
Eukaryotes |
700 |
0.86 |
Binding ≤ 10μM
|
GRM1-3-E |
Metabotropic Glutamate Receptor 1 (cluster #3 Of 3), Eukaryotic |
Eukaryotes |
570 |
0.87 |
Binding ≤ 10μM
|
GRM2-1-E |
Metabotropic Glutamate Receptor 2 (cluster #1 Of 2), Eukaryotic |
Eukaryotes |
7400 |
0.72 |
Binding ≤ 10μM
|
GRM3-1-E |
Metabotropic Glutamate Receptor 3 (cluster #1 Of 1), Eukaryotic |
Eukaryotes |
3000 |
0.77 |
Binding ≤ 10μM
|
GRM4-3-E |
Metabotropic Glutamate Receptor 4 (cluster #3 Of 3), Eukaryotic |
Eukaryotes |
2400 |
0.79 |
Binding ≤ 10μM
|
GRM5-4-E |
Metabotropic Glutamate Receptor 5 (cluster #4 Of 5), Eukaryotic |
Eukaryotes |
4100 |
0.75 |
Binding ≤ 10μM
|
GRM6-1-E |
Metabotropic Glutamate Receptor 6 (cluster #1 Of 1), Eukaryotic |
Eukaryotes |
7600 |
0.72 |
Binding ≤ 10μM
|
GRM8-1-E |
Metabotropic Glutamate Receptor 8 (cluster #1 Of 2), Eukaryotic |
Eukaryotes |
3400 |
0.77 |
Binding ≤ 10μM
|
NMDZ1-4-E |
Glutamate (NMDA) Receptor Subunit Zeta 1 (cluster #4 Of 6), Eukaryotic |
Eukaryotes |
450 |
0.89 |
Binding ≤ 10μM
|
GRIA1-3-E |
Glutamate Receptor Ionotropic, AMPA 1 (cluster #3 Of 3), Eukaryotic |
Eukaryotes |
6160 |
0.73 |
Functional ≤ 10μM
|
GRIA2-3-E |
Glutamate Receptor Ionotropic, AMPA 2 (cluster #3 Of 4), Eukaryotic |
Eukaryotes |
6200 |
0.73 |
Functional ≤ 10μM
|
GRIA3-2-E |
Glutamate Receptor Ionotropic, AMPA 3 (cluster #2 Of 2), Eukaryotic |
Eukaryotes |
3660 |
0.76 |
Functional ≤ 10μM
|
GRM1-4-E |
Metabotropic Glutamate Receptor 1 (cluster #4 Of 5), Eukaryotic |
Eukaryotes |
10000 |
0.70 |
Functional ≤ 10μM
|
GRM2-1-E |
Metabotropic Glutamate Receptor 2 (cluster #1 Of 2), Eukaryotic |
Eukaryotes |
8500 |
0.71 |
Functional ≤ 10μM
|
GRM3-1-E |
Metabotropic Glutamate Receptor 3 (cluster #1 Of 2), Eukaryotic |
Eukaryotes |
9000 |
0.71 |
Functional ≤ 10μM
|
GRM4-1-E |
Metabotropic Glutamate Receptor 4 (cluster #1 Of 1), Eukaryotic |
Eukaryotes |
6100 |
0.73 |
Functional ≤ 10μM
|
GRM5-5-E |
Metabotropic Glutamate Receptor 5 (cluster #5 Of 5), Eukaryotic |
Eukaryotes |
4900 |
0.74 |
Functional ≤ 10μM
|
GRM6-1-E |
Metabotropic Glutamate Receptor 6 (cluster #1 Of 2), Eukaryotic |
Eukaryotes |
7600 |
0.72 |
Functional ≤ 10μM
|
GRM8-1-E |
Metabotropic Glutamate Receptor 8 (cluster #1 Of 2), Eukaryotic |
Eukaryotes |
9500 |
0.70 |
Functional ≤ 10μM
|
NMDE1-1-E |
Glutamate [NMDA] Receptor Subunit Epsilon 1 (cluster #1 Of 2), Eukaryotic |
Eukaryotes |
1800 |
0.80 |
Functional ≤ 10μM
|
NMDZ1-1-E |
Glutamate (NMDA) Receptor Subunit Zeta 1 (cluster #1 Of 3), Eukaryotic |
Eukaryotes |
1800 |
0.80 |
Functional ≤ 10μM
|
Z104302-3-O |
Glutamate NMDA Receptor (cluster #3 Of 7), Other |
Other |
870 |
0.85 |
Binding ≤ 10μM
|
Z50597-3-O |
Rattus Norvegicus (cluster #3 Of 5), Other |
Other |
170 |
0.95 |
Binding ≤ 10μM
|
Z50597-7-O |
Rattus Norvegicus (cluster #7 Of 12), Other |
Other |
1300 |
0.82 |
Functional ≤ 10μM
|
Physical Representations
Type
pH range
|
xlogP
|
Des A‑Pol
Apolar desolvation
(kcal/mol)
|
Des Pol
Polar desolvation
(kcal/mol)
|
H Don
H-bond donors
|
H Acc
H-bond acceptors
|
Chg
Net charge
|
tPSA
(Ų)
|
MWT
Molecular weight
(g/mol)
|
RB
Rotatable bonds
|
DL |
Ref
Reference (pH 7)
|
-3.25 |
1.74 |
-73.91 |
3 |
5 |
-1 |
108 |
146.122 |
4 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Vendors
And 120 More
Clustered Target Annotations
Code |
Organism Class |
Affinity (nM) |
LE (kcal/mol/atom) |
Type |
MURI-2-B |
Glutamate Racemase (cluster #2 Of 2), Bacterial |
Bacteria |
5800 |
0.73 |
Binding ≤ 10μM
|
GRIA1-3-E |
Glutamate Receptor Ionotropic, AMPA 1 (cluster #3 Of 4), Eukaryotic |
Eukaryotes |
1362 |
0.82 |
Binding ≤ 10μM
|
GRIA2-3-E |
Glutamate Receptor Ionotropic, AMPA 2 (cluster #3 Of 4), Eukaryotic |
Eukaryotes |
940 |
0.84 |
Binding ≤ 10μM
|
GRIA3-3-E |
Glutamate Receptor Ionotropic, AMPA 3 (cluster #3 Of 4), Eukaryotic |
Eukaryotes |
500 |
0.88 |
Binding ≤ 10μM
|
GRIA4-3-E |
Glutamate Receptor Ionotropic, AMPA 4 (cluster #3 Of 5), Eukaryotic |
Eukaryotes |
868 |
0.85 |
Binding ≤ 10μM
|
GRIK1-3-E |
Glutamate Receptor Ionotropic Kainate 1 (cluster #3 Of 3), Eukaryotic |
Eukaryotes |
701 |
0.86 |
Binding ≤ 10μM
|
GRIK2-2-E |
Glutamate Receptor Ionotropic Kainate 2 (cluster #2 Of 3), Eukaryotic |
Eukaryotes |
1106 |
0.83 |
Binding ≤ 10μM
|
GRIK3-2-E |
Glutamate Receptor Ionotropic Kainate 3 (cluster #2 Of 3), Eukaryotic |
Eukaryotes |
789 |
0.85 |
Binding ≤ 10μM
|
GRIK4-2-E |
Glutamate Receptor Ionotropic Kainate 4 (cluster #2 Of 2), Eukaryotic |
Eukaryotes |
400 |
0.90 |
Binding ≤ 10μM
|
GRIK5-2-E |
Glutamate Receptor Ionotropic Kainate 5 (cluster #2 Of 2), Eukaryotic |
Eukaryotes |
400 |
0.90 |
Binding ≤ 10μM
|
GRM1-3-E |
Metabotropic Glutamate Receptor 1 (cluster #3 Of 3), Eukaryotic |
Eukaryotes |
4900 |
0.74 |
Binding ≤ 10μM
|
GRM2-1-E |
Metabotropic Glutamate Receptor 2 (cluster #1 Of 2), Eukaryotic |
Eukaryotes |
290 |
0.92 |
Binding ≤ 10μM
|
GRM3-1-E |
Metabotropic Glutamate Receptor 3 (cluster #1 Of 1), Eukaryotic |
Eukaryotes |
1900 |
0.80 |
Binding ≤ 10μM
|
GRM4-3-E |
Metabotropic Glutamate Receptor 4 (cluster #3 Of 3), Eukaryotic |
Eukaryotes |
9800 |
0.70 |
Binding ≤ 10μM
|
GRM5-4-E |
Metabotropic Glutamate Receptor 5 (cluster #4 Of 5), Eukaryotic |
Eukaryotes |
3100 |
0.77 |
Binding ≤ 10μM
|
GRM6-1-E |
Metabotropic Glutamate Receptor 6 (cluster #1 Of 1), Eukaryotic |
Eukaryotes |
4900 |
0.74 |
Binding ≤ 10μM
|
NMDE1-4-E |
Glutamate [NMDA] Receptor Subunit Epsilon 1 (cluster #4 Of 5), Eukaryotic |
Eukaryotes |
200 |
0.94 |
Binding ≤ 10μM
|
NMDE2-4-E |
Glutamate [NMDA] Receptor Subunit Epsilon 2 (cluster #4 Of 5), Eukaryotic |
Eukaryotes |
200 |
0.94 |
Binding ≤ 10μM
|
NMDE3-3-E |
Glutamate [NMDA] Receptor Subunit Epsilon 3 (cluster #3 Of 4), Eukaryotic |
Eukaryotes |
200 |
0.94 |
Binding ≤ 10μM
|
NMDE4-2-E |
Glutamate [NMDA] Receptor Subunit Epsilon 4 (cluster #2 Of 6), Eukaryotic |
Eukaryotes |
200 |
0.94 |
Binding ≤ 10μM
|
GRIA1-3-E |
Glutamate Receptor Ionotropic, AMPA 1 (cluster #3 Of 3), Eukaryotic |
Eukaryotes |
214 |
0.93 |
Functional ≤ 10μM
|
GRIA2-3-E |
Glutamate Receptor Ionotropic, AMPA 2 (cluster #3 Of 4), Eukaryotic |
Eukaryotes |
214 |
0.93 |
Functional ≤ 10μM
|
GRIA3-2-E |
Glutamate Receptor Ionotropic, AMPA 3 (cluster #2 Of 2), Eukaryotic |
Eukaryotes |
214 |
0.93 |
Functional ≤ 10μM
|
GRIA4-2-E |
Glutamate Receptor Ionotropic, AMPA 4 (cluster #2 Of 3), Eukaryotic |
Eukaryotes |
214 |
0.93 |
Functional ≤ 10μM
|
GRM1-4-E |
Metabotropic Glutamate Receptor 1 (cluster #4 Of 5), Eukaryotic |
Eukaryotes |
1050 |
0.84 |
Functional ≤ 10μM
|
GRM8-1-E |
Metabotropic Glutamate Receptor 8 (cluster #1 Of 2), Eukaryotic |
Eukaryotes |
8000 |
0.71 |
Functional ≤ 10μM
|
Z104302-3-O |
Glutamate NMDA Receptor (cluster #3 Of 7), Other |
Other |
80 |
0.99 |
Binding ≤ 10μM |
Z50597-7-O |
Rattus Norvegicus (cluster #7 Of 12), Other |
Other |
2500 |
0.78 |
Functional ≤ 10μM
|
Physical Representations
Type
pH range
|
xlogP
|
Des A‑Pol
Apolar desolvation
(kcal/mol)
|
Des Pol
Polar desolvation
(kcal/mol)
|
H Don
H-bond donors
|
H Acc
H-bond acceptors
|
Chg
Net charge
|
tPSA
(Ų)
|
MWT
Molecular weight
(g/mol)
|
RB
Rotatable bonds
|
DL |
Ref
Reference (pH 7)
|
-3.25 |
1.72 |
-74 |
3 |
5 |
-1 |
108 |
146.122 |
4 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Vendors
Clustered Target Annotations
Code |
Organism Class |
Affinity (nM) |
LE (kcal/mol/atom) |
Type |
GRIA1-3-E |
Glutamate Receptor Ionotropic, AMPA 1 (cluster #3 Of 4), Eukaryotic |
Eukaryotes |
600 |
0.79 |
Binding ≤ 10μM |
GRIA2-3-E |
Glutamate Receptor Ionotropic, AMPA 2 (cluster #3 Of 4), Eukaryotic |
Eukaryotes |
600 |
0.79 |
Binding ≤ 10μM |
GRIA3-3-E |
Glutamate Receptor Ionotropic, AMPA 3 (cluster #3 Of 4), Eukaryotic |
Eukaryotes |
600 |
0.79 |
Binding ≤ 10μM |
GRIA4-3-E |
Glutamate Receptor Ionotropic, AMPA 4 (cluster #3 Of 5), Eukaryotic |
Eukaryotes |
600 |
0.79 |
Binding ≤ 10μM |
GRIK1-3-E |
Glutamate Receptor Ionotropic Kainate 1 (cluster #3 Of 3), Eukaryotic |
Eukaryotes |
1600 |
0.74 |
Binding ≤ 10μM |
GRIK2-2-E |
Glutamate Receptor Ionotropic Kainate 2 (cluster #2 Of 3), Eukaryotic |
Eukaryotes |
1600 |
0.74 |
Binding ≤ 10μM |
GRIK3-2-E |
Glutamate Receptor Ionotropic Kainate 3 (cluster #2 Of 3), Eukaryotic |
Eukaryotes |
1600 |
0.74 |
Binding ≤ 10μM |
GRIK4-2-E |
Glutamate Receptor Ionotropic Kainate 4 (cluster #2 Of 2), Eukaryotic |
Eukaryotes |
1600 |
0.74 |
Binding ≤ 10μM |
GRIK5-2-E |
Glutamate Receptor Ionotropic Kainate 5 (cluster #2 Of 2), Eukaryotic |
Eukaryotes |
1600 |
0.74 |
Binding ≤ 10μM |
Z104302-3-O |
Glutamate NMDA Receptor (cluster #3 Of 7), Other |
Other |
5 |
1.06 |
Binding ≤ 10μM |
Physical Representations
Type
pH range
|
xlogP
|
Des A‑Pol
Apolar desolvation
(kcal/mol)
|
Des Pol
Polar desolvation
(kcal/mol)
|
H Don
H-bond donors
|
H Acc
H-bond acceptors
|
Chg
Net charge
|
tPSA
(Ų)
|
MWT
Molecular weight
(g/mol)
|
RB
Rotatable bonds
|
DL |
Ref
Reference (pH 7)
|
-2.69 |
2.3 |
-80.67 |
3 |
5 |
-1 |
108 |
158.133 |
3 |
↓
|
|
|
Analogs
-
6357664
-
Draw
Identity
99%
90%
80%
70%
Vendors
And 3 More
Clustered Target Annotations
Code |
Organism Class |
Affinity (nM) |
LE (kcal/mol/atom) |
Type |
GRIK1-3-E |
Glutamate Receptor Ionotropic Kainate 1 (cluster #3 Of 3), Eukaryotic |
Eukaryotes |
3 |
1.08 |
Binding ≤ 10μM
|
GRIK2-2-E |
Glutamate Receptor Ionotropic Kainate 2 (cluster #2 Of 3), Eukaryotic |
Eukaryotes |
10 |
1.02 |
Binding ≤ 10μM
|
GRIK3-2-E |
Glutamate Receptor Ionotropic Kainate 3 (cluster #2 Of 3), Eukaryotic |
Eukaryotes |
6 |
1.05 |
Binding ≤ 10μM
|
GRIK4-2-E |
Glutamate Receptor Ionotropic Kainate 4 (cluster #2 Of 2), Eukaryotic |
Eukaryotes |
35 |
0.95 |
Binding ≤ 10μM
|
GRIK5-2-E |
Glutamate Receptor Ionotropic Kainate 5 (cluster #2 Of 2), Eukaryotic |
Eukaryotes |
35 |
0.95 |
Binding ≤ 10μM
|
EAA3-1-E |
Excitatory Amino Acid Transporter 3 (cluster #1 Of 1), Eukaryotic |
Eukaryotes |
6600 |
0.66 |
Functional ≤ 10μM
|
GRM6-1-E |
Metabotropic Glutamate Receptor 6 (cluster #1 Of 2), Eukaryotic |
Eukaryotes |
4000 |
0.69 |
Functional ≤ 10μM
|
Physical Representations
Type
pH range
|
xlogP
|
Des A‑Pol
Apolar desolvation
(kcal/mol)
|
Des Pol
Polar desolvation
(kcal/mol)
|
H Don
H-bond donors
|
H Acc
H-bond acceptors
|
Chg
Net charge
|
tPSA
(Ų)
|
MWT
Molecular weight
(g/mol)
|
RB
Rotatable bonds
|
DL |
Ref
Reference (pH 7)
|
-2.77 |
2.24 |
-66.93 |
3 |
5 |
-1 |
108 |
160.149 |
4 |
↓
|
|
|
Analogs
-
6357664
-
Draw
Identity
99%
90%
80%
70%
Vendors
Clustered Target Annotations
Code |
Organism Class |
Affinity (nM) |
LE (kcal/mol/atom) |
Type |
GRIK1-3-E |
Glutamate Receptor Ionotropic Kainate 1 (cluster #3 Of 3), Eukaryotic |
Eukaryotes |
330 |
0.82 |
Binding ≤ 10μM
|
GRIK2-2-E |
Glutamate Receptor Ionotropic Kainate 2 (cluster #2 Of 3), Eukaryotic |
Eukaryotes |
330 |
0.82 |
Binding ≤ 10μM
|
GRIK3-2-E |
Glutamate Receptor Ionotropic Kainate 3 (cluster #2 Of 3), Eukaryotic |
Eukaryotes |
330 |
0.82 |
Binding ≤ 10μM
|
GRIK4-2-E |
Glutamate Receptor Ionotropic Kainate 4 (cluster #2 Of 2), Eukaryotic |
Eukaryotes |
330 |
0.82 |
Binding ≤ 10μM
|
GRIK5-2-E |
Glutamate Receptor Ionotropic Kainate 5 (cluster #2 Of 2), Eukaryotic |
Eukaryotes |
330 |
0.82 |
Binding ≤ 10μM
|
Physical Representations
Type
pH range
|
xlogP
|
Des A‑Pol
Apolar desolvation
(kcal/mol)
|
Des Pol
Polar desolvation
(kcal/mol)
|
H Don
H-bond donors
|
H Acc
H-bond acceptors
|
Chg
Net charge
|
tPSA
(Ų)
|
MWT
Molecular weight
(g/mol)
|
RB
Rotatable bonds
|
DL |
Ref
Reference (pH 7)
|
-2.77 |
-2.23 |
-79.67 |
3 |
5 |
-1 |
107 |
160.149 |
4 |
↓
|
|
|
Analogs
-
6357664
-
Draw
Identity
99%
90%
80%
70%
Vendors
Clustered Target Annotations
Code |
Organism Class |
Affinity (nM) |
LE (kcal/mol/atom) |
Type |
GRIK1-3-E |
Glutamate Receptor Ionotropic Kainate 1 (cluster #3 Of 3), Eukaryotic |
Eukaryotes |
310 |
0.83 |
Binding ≤ 10μM
|
GRIK2-2-E |
Glutamate Receptor Ionotropic Kainate 2 (cluster #2 Of 3), Eukaryotic |
Eukaryotes |
310 |
0.83 |
Binding ≤ 10μM
|
GRIK3-2-E |
Glutamate Receptor Ionotropic Kainate 3 (cluster #2 Of 3), Eukaryotic |
Eukaryotes |
310 |
0.83 |
Binding ≤ 10μM
|
GRIK4-2-E |
Glutamate Receptor Ionotropic Kainate 4 (cluster #2 Of 2), Eukaryotic |
Eukaryotes |
310 |
0.83 |
Binding ≤ 10μM
|
GRIK5-2-E |
Glutamate Receptor Ionotropic Kainate 5 (cluster #2 Of 2), Eukaryotic |
Eukaryotes |
310 |
0.83 |
Binding ≤ 10μM
|
GRM1-4-E |
Metabotropic Glutamate Receptor 1 (cluster #4 Of 5), Eukaryotic |
Eukaryotes |
10000 |
0.64 |
Functional ≤ 10μM
|
GRM2-1-E |
Metabotropic Glutamate Receptor 2 (cluster #1 Of 2), Eukaryotic |
Eukaryotes |
2000 |
0.73 |
Functional ≤ 10μM
|
Physical Representations
Type
pH range
|
xlogP
|
Des A‑Pol
Apolar desolvation
(kcal/mol)
|
Des Pol
Polar desolvation
(kcal/mol)
|
H Don
H-bond donors
|
H Acc
H-bond acceptors
|
Chg
Net charge
|
tPSA
(Ų)
|
MWT
Molecular weight
(g/mol)
|
RB
Rotatable bonds
|
DL |
Ref
Reference (pH 7)
|
-2.77 |
2.23 |
-73.7 |
3 |
5 |
-1 |
108 |
160.149 |
4 |
↓
|
|
|
Analogs
-
6357664
-
Draw
Identity
99%
90%
80%
70%
Vendors
Clustered Target Annotations
Code |
Organism Class |
Affinity (nM) |
LE (kcal/mol/atom) |
Type |
GRIK1-3-E |
Glutamate Receptor Ionotropic Kainate 1 (cluster #3 Of 3), Eukaryotic |
Eukaryotes |
82 |
0.90 |
Binding ≤ 10μM
|
GRIK2-2-E |
Glutamate Receptor Ionotropic Kainate 2 (cluster #2 Of 3), Eukaryotic |
Eukaryotes |
82 |
0.90 |
Binding ≤ 10μM
|
GRIK3-2-E |
Glutamate Receptor Ionotropic Kainate 3 (cluster #2 Of 3), Eukaryotic |
Eukaryotes |
82 |
0.90 |
Binding ≤ 10μM
|
GRIK4-2-E |
Glutamate Receptor Ionotropic Kainate 4 (cluster #2 Of 2), Eukaryotic |
Eukaryotes |
82 |
0.90 |
Binding ≤ 10μM
|
GRIK5-2-E |
Glutamate Receptor Ionotropic Kainate 5 (cluster #2 Of 2), Eukaryotic |
Eukaryotes |
82 |
0.90 |
Binding ≤ 10μM
|
Physical Representations
Type
pH range
|
xlogP
|
Des A‑Pol
Apolar desolvation
(kcal/mol)
|
Des Pol
Polar desolvation
(kcal/mol)
|
H Don
H-bond donors
|
H Acc
H-bond acceptors
|
Chg
Net charge
|
tPSA
(Ų)
|
MWT
Molecular weight
(g/mol)
|
RB
Rotatable bonds
|
DL |
Ref
Reference (pH 7)
|
-2.77 |
-2.28 |
-77.16 |
3 |
5 |
-1 |
107 |
160.149 |
4 |
↓
|
|
|
Analogs
Draw
Identity
99%
90%
80%
70%
Vendors
Clustered Target Annotations
Code |
Organism Class |
Affinity (nM) |
LE (kcal/mol/atom) |
Type |
GRIA1-3-E |
Glutamate Receptor Ionotropic, AMPA 1 (cluster #3 Of 4), Eukaryotic |
Eukaryotes |
9200 |
0.35 |
Binding ≤ 10μM
|
GRIA2-3-E |
Glutamate Receptor Ionotropic, AMPA 2 (cluster #3 Of 4), Eukaryotic |
Eukaryotes |
4800 |
0.37 |
Binding ≤ 10μM
|
GRIA3-3-E |
Glutamate Receptor Ionotropic, AMPA 3 (cluster #3 Of 4), Eukaryotic |
Eukaryotes |
4800 |
0.37 |
Binding ≤ 10μM
|
GRIA4-3-E |
Glutamate Receptor Ionotropic, AMPA 4 (cluster #3 Of 5), Eukaryotic |
Eukaryotes |
4800 |
0.37 |
Binding ≤ 10μM
|
GRIK1-3-E |
Glutamate Receptor Ionotropic Kainate 1 (cluster #3 Of 3), Eukaryotic |
Eukaryotes |
4200 |
0.38 |
Binding ≤ 10μM
|
GRIK2-2-E |
Glutamate Receptor Ionotropic Kainate 2 (cluster #2 Of 3), Eukaryotic |
Eukaryotes |
2100 |
0.40 |
Binding ≤ 10μM
|
GRIK4-2-E |
Glutamate Receptor Ionotropic Kainate 4 (cluster #2 Of 2), Eukaryotic |
Eukaryotes |
4200 |
0.38 |
Binding ≤ 10μM
|
GRIK5-2-E |
Glutamate Receptor Ionotropic Kainate 5 (cluster #2 Of 2), Eukaryotic |
Eukaryotes |
4200 |
0.38 |
Binding ≤ 10μM
|
GRIA1-3-E |
Glutamate Receptor Ionotropic, AMPA 1 (cluster #3 Of 3), Eukaryotic |
Eukaryotes |
6000 |
0.37 |
Functional ≤ 10μM
|
GRIA2-3-E |
Glutamate Receptor Ionotropic, AMPA 2 (cluster #3 Of 4), Eukaryotic |
Eukaryotes |
6000 |
0.37 |
Functional ≤ 10μM
|
GRIA3-2-E |
Glutamate Receptor Ionotropic, AMPA 3 (cluster #2 Of 2), Eukaryotic |
Eukaryotes |
6000 |
0.37 |
Functional ≤ 10μM
|
GRIA4-2-E |
Glutamate Receptor Ionotropic, AMPA 4 (cluster #2 Of 3), Eukaryotic |
Eukaryotes |
6000 |
0.37 |
Functional ≤ 10μM
|
GRIK1-2-E |
Glutamate Receptor Ionotropic Kainate 1 (cluster #2 Of 2), Eukaryotic |
Eukaryotes |
230 |
0.46 |
Functional ≤ 10μM
|
GRIK2-2-E |
Glutamate Receptor Ionotropic Kainate 2 (cluster #2 Of 2), Eukaryotic |
Eukaryotes |
230 |
0.46 |
Functional ≤ 10μM
|
GRIK3-1-E |
Glutamate Receptor Ionotropic Kainate 3 (cluster #1 Of 1), Eukaryotic |
Eukaryotes |
230 |
0.46 |
Functional ≤ 10μM
|
GRIK4-1-E |
Glutamate Receptor Ionotropic Kainate 4 (cluster #1 Of 1), Eukaryotic |
Eukaryotes |
230 |
0.46 |
Functional ≤ 10μM
|
GRIK5-1-E |
Glutamate Receptor Ionotropic Kainate 5 (cluster #1 Of 1), Eukaryotic |
Eukaryotes |
230 |
0.46 |
Functional ≤ 10μM
|
Z50597-1-O |
Rattus Norvegicus (cluster #1 Of 12), Other |
Other |
6000 |
0.37 |
Functional ≤ 10μM
|
Physical Representations
Type
pH range
|
xlogP
|
Des A‑Pol
Apolar desolvation
(kcal/mol)
|
Des Pol
Polar desolvation
(kcal/mol)
|
H Don
H-bond donors
|
H Acc
H-bond acceptors
|
Chg
Net charge
|
tPSA
(Ų)
|
MWT
Molecular weight
(g/mol)
|
RB
Rotatable bonds
|
DL |
Ref
Reference (pH 7)
|
-0.53 |
4.85 |
-68.53 |
2 |
7 |
-1 |
110 |
278.336 |
4 |
↓
|
Mid
Mid (pH 6-8)
|
-0.53 |
3.91 |
-46.21 |
3 |
7 |
0 |
111 |
279.344 |
4 |
↓
|
|