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Display Options:
Molecule Type
Mechanism of Action
Route of Adminstration
Status
Therapeutic Indication
Number of compounds:
7959
BI-2536
(2)
Small molecule
Serine/threonine-protein kinase PLK1 inhibitor
Unknown
Investigational
Unknown
BI-2536
×
Maximum Phase:
2
First Approval:
None
UNII:
4LJG22T9C6
Molecule Type:
Small molecule
Molecular Formula:
C28H39N7O3
Molecular Weight:
521.67
AlogP:
3.56
PSA:
102.93
HBD:
2.0
HBA:
#RotB:
7.0
Source:
SHP-627
(2)
Small molecule
Unknown
Unknown
Investigational
Unknown
SHP-627
×
Maximum Phase:
2
First Approval:
None
UNII:
C6V7ZU2NPR
Molecule Type:
Small molecule
Molecular Formula:
C20H17NO5
Molecular Weight:
351.36
AlogP:
3.06
PSA:
84.86
HBD:
2.0
HBA:
#RotB:
7.0
Source:
IP-2018
(2)
Small molecule
Unknown
Unknown
Investigational
Unknown
IP-2018
×
Maximum Phase:
2
First Approval:
None
UNII:
60XT58V8NZ
Molecule Type:
Small molecule
Molecular Formula:
C16H17NO3
Molecular Weight:
271.32
AlogP:
2.45
PSA:
51.47
HBD:
1.0
HBA:
#RotB:
2.0
Source:
CMX-2043
(2)
Small molecule
Unknown
Unknown
Investigational
Unknown
CMX-2043
×
Maximum Phase:
2
First Approval:
None
UNII:
83V80O4XY1
Molecule Type:
Small molecule
Molecular Formula:
C16H26N2O6S2
Molecular Weight:
406.53
AlogP:
1.64
PSA:
132.8
HBD:
4.0
HBA:
#RotB:
12.0
Source:
SOFINICLINE
(2)
Small molecule
Neuronal acetylcholine receptor; alpha4/beta2 agonist
Unknown
Investigational
Unknown
SOFINICLINE
×
Maximum Phase:
2
First Approval:
None
UNII:
SQC232V4YY
Molecule Type:
Small molecule
Molecular Formula:
C10H11Cl2N3
Molecular Weight:
244.12
AlogP:
1.8
PSA:
28.16
HBD:
1.0
HBA:
#RotB:
1.0
Source:
BRIVUDINE
(2)
Small molecule
Unknown
Unknown
Investigational
Unknown
BRIVUDINE
×
Maximum Phase:
2
First Approval:
None
UNII:
2M3055079H
Molecule Type:
Small molecule
Molecular Formula:
C11H13BrN2O5
Molecular Weight:
333.14
AlogP:
-0.46
PSA:
104.55
HBD:
3.0
HBA:
#RotB:
3.0
Source:
AZD9056
(2)
Small molecule
P2X purinoceptor 7 antagonist
Unknown
Investigational
Unknown
AZD9056
×
Maximum Phase:
2
First Approval:
None
UNII:
F13K378W4L
Molecule Type:
Small molecule
Molecular Formula:
C24H35ClN2O2
Molecular Weight:
419.01
AlogP:
4.19
PSA:
61.36
HBD:
3.0
HBA:
#RotB:
10.0
Source:
TELAGLENASTAT
(2)
Small molecule
Unknown
Unknown
Investigational
Unknown
TELAGLENASTAT
×
Maximum Phase:
2
First Approval:
None
UNII:
U6CL98GLP4
Molecule Type:
Small molecule
Molecular Formula:
C26H24F3N7O3S
Molecular Weight:
571.59
AlogP:
4.55
PSA:
131.88
HBD:
2.0
HBA:
#RotB:
12.0
Source:
TIPELUKAST
(2)
Small molecule
Unknown
Unknown
Investigational
Unknown
TIPELUKAST
×
Maximum Phase:
2
First Approval:
None
UNII:
08379P260O
Molecule Type:
Small molecule
Molecular Formula:
C29H38O7S
Molecular Weight:
530.68
AlogP:
6.51
PSA:
110.13
HBD:
2.0
HBA:
#RotB:
17.0
Source:
AZD4818
(2)
Small molecule
C-C chemokine receptor type 1 antagonist
Unknown
Investigational
Unknown
AZD4818
×
Maximum Phase:
2
First Approval:
None
UNII:
S5UP6P540K
Molecule Type:
Small molecule
Molecular Formula:
C24H32ClN3O4
Molecular Weight:
461.99
AlogP:
3.39
PSA:
94.06
HBD:
4.0
HBA:
#RotB:
9.0
Source:
HYDROXYFLUTAMIDE
(2)
Small molecule
Unknown
Unknown
Investigational
Unknown
HYDROXYFLUTAMIDE
×
Maximum Phase:
2
First Approval:
None
UNII:
31D90UKP5Y
Molecule Type:
Small molecule
Molecular Formula:
C11H11F3N2O4
Molecular Weight:
292.21
AlogP:
2.32
PSA:
92.47
HBD:
2.0
HBA:
#RotB:
3.0
Source:
MB-07803
(2)
Small molecule
Unknown
Unknown
Investigational
Unknown
MB-07803
×
Maximum Phase:
2
First Approval:
None
UNII:
GG81XF45C2
Molecule Type:
Small molecule
Molecular Formula:
C24H37N4O7PS
Molecular Weight:
556.62
AlogP:
3.9
PSA:
162.85
HBD:
3.0
HBA:
#RotB:
11.0
Source:
NAVAFENTEROL
(2)
Small molecule
Beta-2 adrenergic receptor agonist
Unknown
Investigational
Unknown
NAVAFENTEROL
×
Maximum Phase:
2
First Approval:
None
UNII:
U29GY32XJ4
Molecule Type:
Small molecule
Molecular Formula:
C38H42N6O6S2
Molecular Weight:
742.92
AlogP:
5.04
PSA:
165.83
HBD:
5.0
HBA:
#RotB:
14.0
Source:
CB-103
(2)
Small molecule
Unknown
Unknown
Investigational
Unknown
CB-103
×
Maximum Phase:
2
First Approval:
None
UNII:
Q5BB91JL0V
Molecule Type:
Small molecule
Molecular Formula:
C15H18N2O
Molecular Weight:
242.32
AlogP:
3.75
PSA:
48.14
HBD:
1.0
HBA:
#RotB:
2.0
Source:
ADL-5747
(2)
Small molecule
Delta opioid receptor agonist
Unknown
Investigational
Unknown
ADL-5747
×
Maximum Phase:
2
First Approval:
None
UNII:
BRJ718SA03
Molecule Type:
Small molecule
Molecular Formula:
C24H29ClN2O3
Molecular Weight:
428.96
AlogP:
3.82
PSA:
61.8
HBD:
2.0
HBA:
#RotB:
4.0
Source:
HISTIDINE
(2)
Small molecule
Unknown
Unknown
Investigational
Unknown
HISTIDINE
×
Maximum Phase:
2
First Approval:
None
UNII:
4QD397987E
Molecule Type:
Small molecule
Molecular Formula:
C6H9N3O2
Molecular Weight:
155.16
AlogP:
-0.64
PSA:
92.0
HBD:
3.0
HBA:
#RotB:
3.0
Source:
PEMRAMETOSTAT
(2)
Small molecule
Unknown
Unknown
Investigational
Unknown
PEMRAMETOSTAT
×
Maximum Phase:
2
First Approval:
None
UNII:
VXT8SZ6875
Molecule Type:
Small molecule
Molecular Formula:
C24H32N6O3
Molecular Weight:
452.56
AlogP:
1.05
PSA:
110.69
HBD:
3.0
HBA:
#RotB:
7.0
Source:
6,7-DIHYDRO-5H-PYRROLO[3,4-B]PYRIDINE
(2)
Small molecule
Unknown
Unknown
Investigational
Unknown
6,7-DIHYDRO-5H-PYRROLO[3,4-B]PYRIDINE
×
Maximum Phase:
2
First Approval:
None
UNII:
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
GRC-6211
(2)
Small molecule
Vanilloid receptor antagonist
Unknown
Investigational
Unknown
GRC-6211
×
Maximum Phase:
2
First Approval:
None
UNII:
4S841S9BO9
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
IMPLITAPIDE
(2)
Small molecule
Microsomal triglyceride transfer protein inhibitor
Unknown
Investigational
Unknown
IMPLITAPIDE
×
Maximum Phase:
2
First Approval:
None
UNII:
Q70OH404HR
Molecule Type:
Small molecule
Molecular Formula:
C35H37N3O2
Molecular Weight:
531.7
AlogP:
6.98
PSA:
67.15
HBD:
2.0
HBA:
#RotB:
8.0
Source:
MISONIDAZOLE
(2)
Small molecule
Unknown
Unknown
Investigational
Unknown
MISONIDAZOLE
×
Maximum Phase:
2
First Approval:
None
UNII:
8FE7LTN8XE
Molecule Type:
Small molecule
Molecular Formula:
C7H11N3O4
Molecular Weight:
201.18
AlogP:
-0.2
PSA:
90.42
HBD:
1.0
HBA:
#RotB:
5.0
Source:
ETAZOLATE
(2)
Small molecule
GABA receptor beta-3 subunit positive allosteric modulator
Unknown
Investigational
Unknown
ETAZOLATE
×
Maximum Phase:
2
First Approval:
None
UNII:
I89Y79062L
Molecule Type:
Small molecule
Molecular Formula:
C14H19N5O2
Molecular Weight:
289.34
AlogP:
2.44
PSA:
81.4
HBD:
1.0
HBA:
#RotB:
5.0
Source:
OSUNPROTAFIB
(2)
Small molecule
Unknown
Unknown
Investigational
Unknown
OSUNPROTAFIB
×
Maximum Phase:
2
First Approval:
None
UNII:
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
ABC-294640
(2)
Small molecule
Sphingosine kinase 2 inhibitor
Unknown
Investigational
Unknown
ABC-294640
×
Maximum Phase:
2
First Approval:
None
UNII:
DRG21OQ517
Molecule Type:
Small molecule
Molecular Formula:
C23H25ClN2O
Molecular Weight:
380.92
AlogP:
4.89
PSA:
41.99
HBD:
1.0
HBA:
#RotB:
4.0
Source:
GRANOTAPIDE
(2)
Small molecule
Unknown
Unknown
Investigational
Unknown
GRANOTAPIDE
×
Maximum Phase:
2
First Approval:
None
UNII:
PSZ2YGB0DK
Molecule Type:
Small molecule
Molecular Formula:
C39H37F3N2O8
Molecular Weight:
718.73
AlogP:
6.48
PSA:
128.31
HBD:
1.0
HBA:
#RotB:
13.0
Source:
ABEDITEROL
(2)
Small molecule
Beta-2 adrenergic receptor agonist
Unknown
Investigational
Unknown
ABEDITEROL
×
Maximum Phase:
2
First Approval:
None
UNII:
QXA167CM6F
Molecule Type:
Small molecule
Molecular Formula:
C25H30F2N2O4
Molecular Weight:
460.52
AlogP:
4.23
PSA:
94.58
HBD:
4.0
HBA:
#RotB:
13.0
Source:
GSK-2636771
(2)
Small molecule
PI3-kinase p110-beta subunit inhibitor
Unknown
Investigational
Unknown
GSK-2636771
×
Maximum Phase:
2
First Approval:
None
UNII:
DW94IAT0LS
Molecule Type:
Small molecule
Molecular Formula:
C22H22F3N3O3
Molecular Weight:
433.43
AlogP:
4.26
PSA:
67.59
HBD:
1.0
HBA:
#RotB:
4.0
Source:
NAVARIXIN
(2)
Small molecule
Interleukin-8 receptor A antagonist
Unknown
Investigational
Unknown
NAVARIXIN
×
Maximum Phase:
2
First Approval:
None
UNII:
7V3BY6G538
Molecule Type:
Small molecule
Molecular Formula:
C21H23N3O5
Molecular Weight:
397.43
AlogP:
2.9
PSA:
111.88
HBD:
3.0
HBA:
#RotB:
7.0
Source:
LERIGLITAZONE
(2)
Small molecule
Peroxisome proliferator-activated receptor gamma agonist
Unknown
Investigational
Unknown
LERIGLITAZONE
×
Maximum Phase:
2
First Approval:
None
UNII:
K824X25AYA
Molecule Type:
Small molecule
Molecular Formula:
C19H20N2O4S
Molecular Weight:
372.45
AlogP:
2.65
PSA:
88.52
HBD:
2.0
HBA:
#RotB:
7.0
Source:
AVN-944
(2)
Small molecule
Inosine-5'-monophosphate dehydrogenase (IMPDH) inhibitor
Unknown
Investigational
Unknown
AVN-944
×
Maximum Phase:
2
First Approval:
None
UNII:
I3NPL1V48Q
Molecule Type:
Small molecule
Molecular Formula:
C25H27N5O5
Molecular Weight:
477.52
AlogP:
5.47
PSA:
138.51
HBD:
3.0
HBA:
#RotB:
9.0
Source:
NV-5138
(2)
Small molecule
Unknown
Unknown
Investigational
Unknown
NV-5138
×
Maximum Phase:
2
First Approval:
None
UNII:
06CA9QMG6Z
Molecule Type:
Small molecule
Molecular Formula:
C7H13F2NO2
Molecular Weight:
181.18
AlogP:
1.08
PSA:
63.32
HBD:
2.0
HBA:
#RotB:
4.0
Source:
BRILACIDIN TETRAHYDROCHLORIDE
(2)
Small molecule
Unknown
Unknown
Investigational
Unknown
BRILACIDIN TETRAHYDROCHLORIDE
×
Maximum Phase:
2
First Approval:
None
UNII:
CM3HYX69SK
Molecule Type:
Small molecule
Molecular Formula:
C40H54Cl4F6N14O6
Molecular Weight:
1082.76
AlogP:
3.68
PSA:
308.5
HBD:
12.0
HBA:
#RotB:
20.0
Source:
FADOLMIDINE HYDROCHLORIDE
(2)
Small molecule
Adrenergic receptor alpha-2 agonist
Unknown
Investigational
Unknown
FADOLMIDINE HYDROCHLORIDE
×
Maximum Phase:
2
First Approval:
None
UNII:
S3709T25V6
Molecule Type:
Small molecule
Molecular Formula:
C13H15ClN2O
Molecular Weight:
250.73
AlogP:
2.39
PSA:
48.91
HBD:
2.0
HBA:
#RotB:
2.0
Source:
BMX-001
(2)
Small molecule
Metalloporphyrin antioxidant (antitumor, radioprotectant)
Unknown
Investigational
Unknown
BMX-001
×
Maximum Phase:
2
First Approval:
None
UNII:
MIJ02RO47F
Molecule Type:
Small molecule
Molecular Formula:
C64H76Cl5MnN8O4
Molecular Weight:
1253.57
AlogP:
None
PSA:
None
HBD:
None
HBA:
#RotB:
None
Source:
ADIPIPLON
(2)
Small molecule
GABA-A receptor; anion channel partial agonist
Unknown
Investigational
Unknown
ADIPIPLON
×
Maximum Phase:
2
First Approval:
None
UNII:
OPL214POJ1
Molecule Type:
Small molecule
Molecular Formula:
C18H18FN7
Molecular Weight:
351.39
AlogP:
2.83
PSA:
73.79
HBD:
0.0
HBA:
#RotB:
5.0
Source:
GSK163090
(2)
Small molecule
Serotonin 1a (5-HT1a) receptor antagonist
Unknown
Investigational
Unknown
GSK163090
×
Maximum Phase:
2
First Approval:
None
UNII:
7XI927X82B
Molecule Type:
Small molecule
Molecular Formula:
C25H29N5O
Molecular Weight:
415.54
AlogP:
3.44
PSA:
51.71
HBD:
1.0
HBA:
#RotB:
5.0
Source:
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Molecular Formula
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ALogP
PSA