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Display Options:
Molecule Type
Mechanism of Action
Route of Adminstration
Status
Therapeutic Indication
Number of compounds:
7959
BDTX189
(1)
Small molecule
Epidermal growth factor receptor erbB1 negative allosteric modulator
Unknown
Investigational
Unknown
BDTX189
×
Maximum Phase:
1
First Approval:
None
UNII:
6CE2107J4T
Molecule Type:
Small molecule
Molecular Formula:
C29H29ClN6O4
Molecular Weight:
561.04
AlogP:
4.84
PSA:
110.73
HBD:
2.0
HBA:
#RotB:
11.0
Source:
CEP-2563
(1)
Small molecule
Neurotrophic tyrosine kinase receptor inhibitor
Unknown
Investigational
Unknown
CEP-2563
×
Maximum Phase:
1
First Approval:
None
UNII:
ASM3TU522N
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
CHROMIUM PICOLINATE
(1)
Small molecule
Unknown
Unknown
Approved
Unknown
CHROMIUM PICOLINATE
×
Maximum Phase:
1
First Approval:
None
UNII:
S71T8B8Z6P
Molecule Type:
Small molecule
Molecular Formula:
C18H12CrN3O6
Molecular Weight:
417.25
AlogP:
None
PSA:
None
HBD:
None
HBA:
#RotB:
None
Source:
ST1535
(1)
Small molecule
Adenosine A2a receptor antagonist
Unknown
Investigational
Unknown
ST1535
×
Maximum Phase:
1
First Approval:
None
UNII:
None
Molecule Type:
Small molecule
Molecular Formula:
C12H16N8
Molecular Weight:
272.32
AlogP:
0.87
PSA:
100.33
HBD:
1.0
HBA:
#RotB:
4.0
Source:
SERIDOPIDINE
(1)
Small molecule
Dopamine D2 receptor modulator
Unknown
Investigational
Unknown
SERIDOPIDINE
×
Maximum Phase:
1
First Approval:
None
UNII:
1359K87ZYE
Molecule Type:
Small molecule
Molecular Formula:
C14H20FNO2S
Molecular Weight:
285.38
AlogP:
2.43
PSA:
37.38
HBD:
0.0
HBA:
#RotB:
3.0
Source:
JTE-151
(1)
Small molecule
Nuclear receptor ROR-gamma antagonist
Unknown
Investigational
Unknown
JTE-151
×
Maximum Phase:
1
First Approval:
None
UNII:
JVS2L11ROA
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
TRICHOSTATIN
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
TRICHOSTATIN
×
Maximum Phase:
1
First Approval:
None
UNII:
3X2S926L3Z
Molecule Type:
Small molecule
Molecular Formula:
C17H22N2O3
Molecular Weight:
302.37
AlogP:
2.58
PSA:
69.64
HBD:
2.0
HBA:
#RotB:
6.0
Source:
CARBACYCLIC PHOSPHATIDIC ACID
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
CARBACYCLIC PHOSPHATIDIC ACID
×
Maximum Phase:
1
First Approval:
None
UNII:
OXV962AR86
Molecule Type:
Small molecule
Molecular Formula:
C22H41O5P
Molecular Weight:
416.54
AlogP:
6.4
PSA:
72.83
HBD:
1.0
HBA:
#RotB:
17.0
Source:
AZD-3839
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
AZD-3839
×
Maximum Phase:
1
First Approval:
None
UNII:
I8ID590133
Molecule Type:
Small molecule
Molecular Formula:
C24H16F3N5
Molecular Weight:
431.42
AlogP:
4.63
PSA:
77.05
HBD:
1.0
HBA:
#RotB:
4.0
Source:
SLC-0111
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
SLC-0111
×
Maximum Phase:
1
First Approval:
None
UNII:
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
RGI-7000
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
RGI-7000
×
Maximum Phase:
1
First Approval:
None
UNII:
WX671898JF
Molecule Type:
Small molecule
Molecular Formula:
C50H99NO9
Molecular Weight:
858.34
AlogP:
10.48
PSA:
168.94
HBD:
7.0
HBA:
#RotB:
44.0
Source:
KETOPROFEN LYSINE
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
KETOPROFEN LYSINE
×
Maximum Phase:
1
First Approval:
None
UNII:
5WD00E3D4C
Molecule Type:
Small molecule
Molecular Formula:
C22H28N2O5
Molecular Weight:
400.48
AlogP:
3.11
PSA:
54.37
HBD:
1.0
HBA:
#RotB:
4.0
Source:
CT-7001
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
CT-7001
×
Maximum Phase:
1
First Approval:
None
UNII:
46D4HS9ODA
Molecule Type:
Small molecule
Molecular Formula:
C22H30N6O
Molecular Weight:
394.52
AlogP:
2.85
PSA:
86.51
HBD:
4.0
HBA:
#RotB:
7.0
Source:
PF-05241328
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
PF-05241328
×
Maximum Phase:
1
First Approval:
None
UNII:
8RAL5N48VT
Molecule Type:
Small molecule
Molecular Formula:
C19H21ClN4O4S
Molecular Weight:
436.92
AlogP:
3.11
PSA:
103.18
HBD:
1.0
HBA:
#RotB:
6.0
Source:
APOCYNIN
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
APOCYNIN
×
Maximum Phase:
1
First Approval:
None
UNII:
B6J7B9UDTR
Molecule Type:
Small molecule
Molecular Formula:
C9H10O3
Molecular Weight:
166.18
AlogP:
1.6
PSA:
46.53
HBD:
1.0
HBA:
#RotB:
2.0
Source:
HENATINIB
(1)
Small molecule
Vascular endothelial growth factor receptor 2 inhibitor
Unknown
Investigational
Unknown
HENATINIB
×
Maximum Phase:
1
First Approval:
None
UNII:
TE20GB753F
Molecule Type:
Small molecule
Molecular Formula:
C25H29FN4O4
Molecular Weight:
468.53
AlogP:
2.04
PSA:
97.9
HBD:
3.0
HBA:
#RotB:
5.0
Source:
SB-756050
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
SB-756050
×
Maximum Phase:
1
First Approval:
None
UNII:
F3EST236LD
Molecule Type:
Small molecule
Molecular Formula:
C21H28N2O8S2
Molecular Weight:
500.6
AlogP:
1.81
PSA:
111.68
HBD:
0.0
HBA:
#RotB:
8.0
Source:
BMS-986104
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
BMS-986104
×
Maximum Phase:
1
First Approval:
None
UNII:
KJ9D084FO4
Molecule Type:
Small molecule
Molecular Formula:
C22H35NO
Molecular Weight:
329.53
AlogP:
4.72
PSA:
46.25
HBD:
2.0
HBA:
#RotB:
7.0
Source:
BAY-1082439
(1)
Small molecule
PI3-kinase p110-alpha subunit inhibitor
Unknown
Investigational
Unknown
BAY-1082439
×
Maximum Phase:
1
First Approval:
None
UNII:
59784ZX4GD
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
AVOTACICLIB
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
AVOTACICLIB
×
Maximum Phase:
1
First Approval:
None
UNII:
Z6BYC0F36E
Molecule Type:
Small molecule
Molecular Formula:
C13H11N7O
Molecular Weight:
281.28
AlogP:
0.87
PSA:
136.72
HBD:
3.0
HBA:
#RotB:
2.0
Source:
IT-139
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
IT-139
×
Maximum Phase:
1
First Approval:
None
UNII:
7OSJ9KS483
Molecule Type:
Small molecule
Molecular Formula:
C14H12Cl4N4NaRu
Molecular Weight:
502.15
AlogP:
None
PSA:
None
HBD:
None
HBA:
#RotB:
None
Source:
MP-412
(1)
Small molecule
Epidermal growth factor receptor erbB1 inhibitor
Unknown
Investigational
Unknown
MP-412
×
Maximum Phase:
1
First Approval:
None
UNII:
Z541VW0W40
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
ACT-001
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
ACT-001
×
Maximum Phase:
1
First Approval:
None
UNII:
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
GW-695634
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
GW-695634
×
Maximum Phase:
1
First Approval:
None
UNII:
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
TAK-733
(1)
Small molecule
Dual specificity mitogen-activated protein kinase kinase 1 inhibitor
Unknown
Investigational
Unknown
TAK-733
×
Maximum Phase:
1
First Approval:
None
UNII:
5J61HSP0QJ
Molecule Type:
Small molecule
Molecular Formula:
C17H15F2IN4O4
Molecular Weight:
504.23
AlogP:
1.07
PSA:
109.38
HBD:
3.0
HBA:
#RotB:
5.0
Source:
CAL-263
(1)
Small molecule
PI3-kinase p110-delta subunit inhibitor
Unknown
Investigational
Unknown
CAL-263
×
Maximum Phase:
1
First Approval:
None
UNII:
None
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
FK453
(1)
Small molecule
Adenosine A1 receptor antagonist
Unknown
Investigational
Unknown
FK453
×
Maximum Phase:
1
First Approval:
None
UNII:
None
Molecule Type:
Small molecule
Molecular Formula:
C23H25N3O2
Molecular Weight:
375.47
AlogP:
3.78
PSA:
57.84
HBD:
1.0
HBA:
#RotB:
5.0
Source:
TELINAVIR
(1)
Small molecule
HIV-1 protease inhibitor
Unknown
Investigational
Unknown
TELINAVIR
×
Maximum Phase:
1
First Approval:
None
UNII:
IZF55EH3CG
Molecule Type:
Small molecule
Molecular Formula:
C33H44N6O5
Molecular Weight:
604.75
AlogP:
2.76
PSA:
166.75
HBD:
5.0
HBA:
#RotB:
13.0
Source:
CFG-920
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
CFG-920
×
Maximum Phase:
1
First Approval:
None
UNII:
UP0K5026VB
Molecule Type:
Small molecule
Molecular Formula:
C14H13ClN4O
Molecular Weight:
288.74
AlogP:
2.89
PSA:
49.33
HBD:
0.0
HBA:
#RotB:
2.0
Source:
CGM-097
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
CGM-097
×
Maximum Phase:
1
First Approval:
None
UNII:
4UF6MSL0ZH
Molecule Type:
Small molecule
Molecular Formula:
C38H47ClN4O4
Molecular Weight:
659.27
AlogP:
6.58
PSA:
65.56
HBD:
0.0
HBA:
#RotB:
9.0
Source:
SNDX-5613
(1)
Small molecule
Menin/Histone-lysine N-methyltransferase MLL inhibitor
Unknown
Investigational
Unknown
SNDX-5613
×
Maximum Phase:
1
First Approval:
None
UNII:
75HI05N8HS
Molecule Type:
Small molecule
Molecular Formula:
C76H106F2N12O20S2
Molecular Weight:
1609.88
AlogP:
4.68
PSA:
107.97
HBD:
1.0
HBA:
#RotB:
11.0
Source:
NACUBACTAM
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
NACUBACTAM
×
Maximum Phase:
1
First Approval:
None
UNII:
832O37V7MZ
Molecule Type:
Small molecule
Molecular Formula:
C9H16N4O7S
Molecular Weight:
324.32
AlogP:
-2.0
PSA:
151.5
HBD:
3.0
HBA:
#RotB:
6.0
Source:
DDO-3055
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
DDO-3055
×
Maximum Phase:
1
First Approval:
None
UNII:
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
CI-988
(1)
Small molecule
Cholecystokinin B receptor antagonist
Unknown
Investigational
Unknown
CI-988
×
Maximum Phase:
1
First Approval:
None
UNII:
2637PDX9SI
Molecule Type:
Small molecule
Molecular Formula:
C35H42N4O6
Molecular Weight:
614.74
AlogP:
4.86
PSA:
149.62
HBD:
5.0
HBA:
#RotB:
12.0
Source:
RAD-140
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
RAD-140
×
Maximum Phase:
1
First Approval:
None
UNII:
4O87Q44KNC
Molecule Type:
Small molecule
Molecular Formula:
C20H16ClN5O2
Molecular Weight:
393.83
AlogP:
3.98
PSA:
118.76
HBD:
2.0
HBA:
#RotB:
5.0
Source:
AZD-6918
(1)
Small molecule
Neurotrophic tyrosine kinase receptor inhibitor
Unknown
Investigational
Unknown
AZD-6918
×
Maximum Phase:
1
First Approval:
None
UNII:
None
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
1
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PSA