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Display Options:
Molecule Type
Mechanism of Action
Route of Adminstration
Status
Therapeutic Indication
Number of compounds:
7959
GACYCLIDINE
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
GACYCLIDINE
×
Maximum Phase:
1
First Approval:
None
UNII:
9290ND070R
Molecule Type:
Small molecule
Molecular Formula:
C16H25NS
Molecular Weight:
263.45
AlogP:
4.64
PSA:
3.24
HBD:
0.0
HBA:
#RotB:
2.0
Source:
BMS-779788
(1)
Small molecule
LXR-beta agonist
Unknown
Investigational
Unknown
BMS-779788
×
Maximum Phase:
1
First Approval:
None
UNII:
FB7ZTJ8M8A
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
AZD-0424
(1)
Small molecule
Tyrosine-protein kinase ABL inhibitor
Unknown
Investigational
Unknown
AZD-0424
×
Maximum Phase:
1
First Approval:
None
UNII:
642PS51324
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
IDRONOXIL
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
IDRONOXIL
×
Maximum Phase:
1
First Approval:
None
UNII:
995FT1W541
Molecule Type:
Small molecule
Molecular Formula:
C15H12O3
Molecular Weight:
240.26
AlogP:
3.03
PSA:
49.69
HBD:
2.0
HBA:
#RotB:
1.0
Source:
RX-518
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
RX-518
×
Maximum Phase:
1
First Approval:
None
UNII:
708TLB8J3Y
Molecule Type:
Small molecule
Molecular Formula:
C29H28F2N6O2
Molecular Weight:
530.58
AlogP:
4.56
PSA:
93.62
HBD:
3.0
HBA:
#RotB:
8.0
Source:
SECLIDEMSTAT
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
SECLIDEMSTAT
×
Maximum Phase:
1
First Approval:
None
UNII:
TYH386V3WJ
Molecule Type:
Small molecule
Molecular Formula:
C20H23ClN4O4S
Molecular Weight:
450.95
AlogP:
2.14
PSA:
102.31
HBD:
2.0
HBA:
#RotB:
5.0
Source:
CYTOCHLOR
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
CYTOCHLOR
×
Maximum Phase:
1
First Approval:
None
UNII:
J14D49ZN55
Molecule Type:
Small molecule
Molecular Formula:
C9H12ClN3O4
Molecular Weight:
261.67
AlogP:
-0.88
PSA:
110.6
HBD:
3.0
HBA:
#RotB:
2.0
Source:
MINOZAC FREE BASE
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
MINOZAC FREE BASE
×
Maximum Phase:
1
First Approval:
None
UNII:
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
FENAMIC ACID
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
FENAMIC ACID
×
Maximum Phase:
1
First Approval:
None
UNII:
952VN06WBB
Molecule Type:
Small molecule
Molecular Formula:
C13H11NO2
Molecular Weight:
213.24
AlogP:
3.13
PSA:
49.33
HBD:
2.0
HBA:
#RotB:
3.0
Source:
LXR-623
(1)
Small molecule
LXR-alpha agonist
Unknown
Investigational
Unknown
LXR-623
×
Maximum Phase:
1
First Approval:
None
UNII:
4W82FEU838
Molecule Type:
Small molecule
Molecular Formula:
C21H12ClF5N2
Molecular Weight:
422.78
AlogP:
6.7
PSA:
17.82
HBD:
0.0
HBA:
#RotB:
3.0
Source:
QC-12
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
QC-12
×
Maximum Phase:
1
First Approval:
None
UNII:
9UA2FPZ3ZK
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
ATF-936
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
ATF-936
×
Maximum Phase:
1
First Approval:
None
UNII:
SV2NZO0LAU
Molecule Type:
Small molecule
Molecular Formula:
C30H30N2O4
Molecular Weight:
482.58
AlogP:
5.65
PSA:
62.58
HBD:
0.0
HBA:
#RotB:
9.0
Source:
KW-2449
(1)
Small molecule
Serine/threonine-protein kinase Aurora-A inhibitor
Unknown
Investigational
Unknown
KW-2449
×
Maximum Phase:
1
First Approval:
None
UNII:
2D9N67F58G
Molecule Type:
Small molecule
Molecular Formula:
C20H20N4O
Molecular Weight:
332.41
AlogP:
2.78
PSA:
61.02
HBD:
2.0
HBA:
#RotB:
3.0
Source:
ALTIRATINIB
(1)
Small molecule
Hepatocyte growth factor receptor inhibitor
Unknown
Investigational
Unknown
ALTIRATINIB
×
Maximum Phase:
1
First Approval:
None
UNII:
T678746713
Molecule Type:
Small molecule
Molecular Formula:
C26H21F3N4O4
Molecular Weight:
510.47
AlogP:
5.0
PSA:
109.42
HBD:
3.0
HBA:
#RotB:
8.0
Source:
VALOMACICLOVIR
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
VALOMACICLOVIR
×
Maximum Phase:
1
First Approval:
None
UNII:
F094Y61748
Molecule Type:
Small molecule
Molecular Formula:
C15H24N6O4
Molecular Weight:
352.4
AlogP:
-0.77
PSA:
162.14
HBD:
4.0
HBA:
#RotB:
8.0
Source:
VEMIRCOPAN
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
VEMIRCOPAN
×
Maximum Phase:
1
First Approval:
None
UNII:
HN6I4K50QB
Molecule Type:
Small molecule
Molecular Formula:
C29H28BrN7O3
Molecular Weight:
602.49
AlogP:
4.49
PSA:
122.97
HBD:
1.0
HBA:
#RotB:
6.0
Source:
TA-5493
(1)
Small molecule
MAP kinase p38 alpha inhibitor
Unknown
Investigational
Unknown
TA-5493
×
Maximum Phase:
1
First Approval:
None
UNII:
None
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
CXD-101
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
CXD-101
×
Maximum Phase:
1
First Approval:
None
UNII:
5TNV87ICD2
Molecule Type:
Small molecule
Molecular Formula:
C24H29N5O
Molecular Weight:
403.53
AlogP:
3.94
PSA:
76.18
HBD:
2.0
HBA:
#RotB:
5.0
Source:
CIPRALISANT MALEATE
(1)
Small molecule
Histamine H3 receptor agonist
Unknown
Investigational
Unknown
CIPRALISANT MALEATE
×
Maximum Phase:
1
First Approval:
None
UNII:
7ENI812SZS
Molecule Type:
Small molecule
Molecular Formula:
C18H24N2O4
Molecular Weight:
332.4
AlogP:
3.34
PSA:
28.68
HBD:
1.0
HBA:
#RotB:
2.0
Source:
AGG-523
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
AGG-523
×
Maximum Phase:
1
First Approval:
None
UNII:
WO23I2827Q
Molecule Type:
Small molecule
Molecular Formula:
C25H21ClN4O4
Molecular Weight:
476.92
AlogP:
4.84
PSA:
108.6
HBD:
2.0
HBA:
#RotB:
7.0
Source:
TAK-441
(1)
Small molecule
Smoothened homolog antagonist
Unknown
Investigational
Unknown
TAK-441
×
Maximum Phase:
1
First Approval:
None
UNII:
CY3QT94KWP
Molecule Type:
Small molecule
Molecular Formula:
C28H31F3N4O6
Molecular Weight:
576.57
AlogP:
2.44
PSA:
122.87
HBD:
2.0
HBA:
#RotB:
9.0
Source:
CENICRIVIROC MESYLATE
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
CENICRIVIROC MESYLATE
×
Maximum Phase:
1
First Approval:
None
UNII:
R96TV84T21
Molecule Type:
Small molecule
Molecular Formula:
C42H56N4O7S2
Molecular Weight:
793.06
AlogP:
8.74
PSA:
85.69
HBD:
1.0
HBA:
#RotB:
17.0
Source:
RTI-336
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
RTI-336
×
Maximum Phase:
1
First Approval:
None
UNII:
667440B6Z7
Molecule Type:
Small molecule
Molecular Formula:
C24H25ClN2O
Molecular Weight:
392.93
AlogP:
6.04
PSA:
29.27
HBD:
0.0
HBA:
#RotB:
3.0
Source:
APG-2449
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
APG-2449
×
Maximum Phase:
1
First Approval:
None
UNII:
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
ITASETRON
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
ITASETRON
×
Maximum Phase:
1
First Approval:
None
UNII:
00S0D0OEKR
Molecule Type:
Small molecule
Molecular Formula:
C16H20N4O2
Molecular Weight:
300.36
AlogP:
1.51
PSA:
70.13
HBD:
2.0
HBA:
#RotB:
1.0
Source:
PF-04620110
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
PF-04620110
×
Maximum Phase:
1
First Approval:
None
UNII:
CQ4M18RLJW
Molecule Type:
Small molecule
Molecular Formula:
C21H24N4O4
Molecular Weight:
396.45
AlogP:
2.85
PSA:
118.64
HBD:
2.0
HBA:
#RotB:
4.0
Source:
EXICORILANT
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
EXICORILANT
×
Maximum Phase:
1
First Approval:
None
UNII:
GTB859B7K8
Molecule Type:
Small molecule
Molecular Formula:
C26H23F4N7O3S
Molecular Weight:
589.58
AlogP:
3.23
PSA:
115.87
HBD:
0.0
HBA:
#RotB:
5.0
Source:
ZETELETINIB
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
ZETELETINIB
×
Maximum Phase:
1
First Approval:
None
UNII:
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
KO-947
(1)
Small molecule
Mitogen-activated protein kinase; ERK1/ERK2 inhibitor
Unknown
Investigational
Unknown
KO-947
×
Maximum Phase:
1
First Approval:
None
UNII:
None
Molecule Type:
Small molecule
Molecular Formula:
C21H17N5O
Molecular Weight:
355.4
AlogP:
4.17
PSA:
73.91
HBD:
2.0
HBA:
#RotB:
3.0
Source:
AZD-8165
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
AZD-8165
×
Maximum Phase:
1
First Approval:
None
UNII:
7WO8I5IY24
Molecule Type:
Small molecule
Molecular Formula:
C23H21ClFN7O4
Molecular Weight:
513.92
AlogP:
2.35
PSA:
131.67
HBD:
1.0
HBA:
#RotB:
8.0
Source:
MITOQUINOL CATION
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
MITOQUINOL CATION
×
Maximum Phase:
1
First Approval:
None
UNII:
65M41NIO61
Molecule Type:
Small molecule
Molecular Formula:
C37H46O4P+
Molecular Weight:
585.75
AlogP:
8.08
PSA:
58.92
HBD:
2.0
HBA:
#RotB:
16.0
Source:
CROBENETINE
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
CROBENETINE
×
Maximum Phase:
1
First Approval:
None
UNII:
Q72DWI2G4C
Molecule Type:
Small molecule
Molecular Formula:
C25H33NO2
Molecular Weight:
379.54
AlogP:
4.91
PSA:
32.7
HBD:
1.0
HBA:
#RotB:
5.0
Source:
CHS-828
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
CHS-828
×
Maximum Phase:
1
First Approval:
None
UNII:
8LAP87DNSZ
Molecule Type:
Small molecule
Molecular Formula:
C19H22ClN5O
Molecular Weight:
371.87
AlogP:
4.21
PSA:
82.33
HBD:
2.0
HBA:
#RotB:
9.0
Source:
MAGNESIUM STEARATE
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
MAGNESIUM STEARATE
×
Maximum Phase:
1
First Approval:
None
UNII:
70097M6I30
Molecule Type:
Small molecule
Molecular Formula:
C36H70MgO4
Molecular Weight:
591.26
AlogP:
None
PSA:
None
HBD:
None
HBA:
#RotB:
None
Source:
FANAPANEL
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
FANAPANEL
×
Maximum Phase:
1
First Approval:
None
UNII:
E3AP71EM0O
Molecule Type:
Small molecule
Molecular Formula:
C14H15F3N3O6P
Molecular Weight:
409.26
AlogP:
0.68
PSA:
124.86
HBD:
3.0
HBA:
#RotB:
3.0
Source:
COCAETHYLENE
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
COCAETHYLENE
×
Maximum Phase:
1
First Approval:
None
UNII:
FJO3071W5Y
Molecule Type:
Small molecule
Molecular Formula:
C18H23NO4
Molecular Weight:
317.39
AlogP:
2.26
PSA:
55.84
HBD:
0.0
HBA:
#RotB:
4.0
Source:
1
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Compound Name
Maximum Phase
Compound Structure
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Inchi
InchiKey
Compound Properties
Molecular Formula
Molecular Weight
ALogP
PSA