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Display Options:
Molecule Type
Mechanism of Action
Route of Adminstration
Status
Therapeutic Indication
Number of compounds:
7959
DM-1157
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
DM-1157
×
Maximum Phase:
1
First Approval:
None
UNII:
6X58GJ0RMS
Molecule Type:
Small molecule
Molecular Formula:
C28H31ClN6
Molecular Weight:
487.05
AlogP:
5.32
PSA:
65.97
HBD:
2.0
HBA:
#RotB:
9.0
Source:
BETA-CARYOPHYLLENE
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
BETA-CARYOPHYLLENE
×
Maximum Phase:
1
First Approval:
None
UNII:
BHW853AU9H
Molecule Type:
Small molecule
Molecular Formula:
C15H24
Molecular Weight:
204.36
AlogP:
4.73
PSA:
0.0
HBD:
0.0
HBA:
#RotB:
0.0
Source:
PF-04217903
(1)
Small molecule
Hepatocyte growth factor receptor inhibitor
Unknown
Investigational
Unknown
PF-04217903
×
Maximum Phase:
1
First Approval:
None
UNII:
CYJ9ATV1IJ
Molecule Type:
Small molecule
Molecular Formula:
C19H16N8O
Molecular Weight:
372.39
AlogP:
1.67
PSA:
107.43
HBD:
1.0
HBA:
#RotB:
5.0
Source:
RO-6870810
(1)
Small molecule
Bromodomain and extra-terminal motif (BET) inhibitor
Unknown
Investigational
Unknown
RO-6870810
×
Maximum Phase:
1
First Approval:
None
UNII:
TA3QN7788D
Molecule Type:
Small molecule
Molecular Formula:
C27H34ClN7OS
Molecular Weight:
540.14
AlogP:
3.94
PSA:
78.65
HBD:
1.0
HBA:
#RotB:
7.0
Source:
CIS-UROCANIC ACID
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
CIS-UROCANIC ACID
×
Maximum Phase:
1
First Approval:
None
UNII:
5LM7WD7VIC
Molecule Type:
Small molecule
Molecular Formula:
C6H6N2O2
Molecular Weight:
138.13
AlogP:
0.51
PSA:
65.98
HBD:
2.0
HBA:
#RotB:
2.0
Source:
PF-114
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
PF-114
×
Maximum Phase:
1
First Approval:
None
UNII:
I8C3R768IZ
Molecule Type:
Small molecule
Molecular Formula:
C29H27F3N6O
Molecular Weight:
532.57
AlogP:
4.46
PSA:
65.77
HBD:
1.0
HBA:
#RotB:
4.0
Source:
NMS-1116354
(1)
Small molecule
Cell division cycle 7-related protein kinase inhibitor
Unknown
Investigational
Unknown
NMS-1116354
×
Maximum Phase:
1
First Approval:
None
UNII:
None
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
RG-7167
(1)
Small molecule
Dual specificity mitogen-activated protein kinase kinase; MEK1/2 inhibitor
Unknown
Investigational
Unknown
RG-7167
×
Maximum Phase:
1
First Approval:
None
UNII:
None
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
AZD-3043
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
AZD-3043
×
Maximum Phase:
1
First Approval:
None
UNII:
372AB76LQL
Molecule Type:
Small molecule
Molecular Formula:
C19H29NO5
Molecular Weight:
351.44
AlogP:
2.83
PSA:
65.07
HBD:
0.0
HBA:
#RotB:
11.0
Source:
1.ALPHA.-HYDROXYVITAMIN D5
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
1.ALPHA.-HYDROXYVITAMIN D5
×
Maximum Phase:
1
First Approval:
None
UNII:
XY02042OD4
Molecule Type:
Small molecule
Molecular Formula:
C29H48O2
Molecular Weight:
428.7
AlogP:
7.23
PSA:
40.46
HBD:
2.0
HBA:
#RotB:
7.0
Source:
TALOTREXIN
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
TALOTREXIN
×
Maximum Phase:
1
First Approval:
None
UNII:
A8E516A20K
Molecule Type:
Small molecule
Molecular Formula:
C27H27N9O6
Molecular Weight:
573.57
AlogP:
1.29
PSA:
248.43
HBD:
7.0
HBA:
#RotB:
12.0
Source:
LY-2780301
(1)
Small molecule
Ribosomal protein S6 kinase (P70S6K) inhibitor
Unknown
Investigational
Unknown
LY-2780301
×
Maximum Phase:
1
First Approval:
None
UNII:
None
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
ARQ-736
(1)
Small molecule
Serine/threonine-protein kinase B-raf inhibitor
Unknown
Investigational
Unknown
ARQ-736
×
Maximum Phase:
1
First Approval:
None
UNII:
Y2H4S74Y8U
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
TAK-593
(1)
Small molecule
Platelet-derived growth factor receptor inhibitor
Unknown
Investigational
Unknown
TAK-593
×
Maximum Phase:
1
First Approval:
None
UNII:
H3I42X8XX7
Molecule Type:
Small molecule
Molecular Formula:
C23H23N7O3
Molecular Weight:
445.48
AlogP:
3.47
PSA:
115.44
HBD:
2.0
HBA:
#RotB:
6.0
Source:
GS-441524
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
GS-441524
×
Maximum Phase:
1
First Approval:
None
UNII:
1BQK176DT6
Molecule Type:
Small molecule
Molecular Formula:
C12H13N5O4
Molecular Weight:
291.27
AlogP:
-1.86
PSA:
149.92
HBD:
4.0
HBA:
#RotB:
2.0
Source:
NKTR-171
(1)
Small molecule
Sodium channel alpha subunit blocker
Unknown
Investigational
Unknown
NKTR-171
×
Maximum Phase:
1
First Approval:
None
UNII:
None
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
INULINE
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
INULINE
×
Maximum Phase:
1
First Approval:
None
UNII:
None
Molecule Type:
Small molecule
Molecular Formula:
C32H46N2O8
Molecular Weight:
586.73
AlogP:
1.72
PSA:
132.94
HBD:
3.0
HBA:
#RotB:
8.0
Source:
ASP-3026
(1)
Small molecule
ALK tyrosine kinase receptor inhibitor
Unknown
Investigational
Unknown
ASP-3026
×
Maximum Phase:
1
First Approval:
None
UNII:
HP4L6MXF10
Molecule Type:
Small molecule
Molecular Formula:
C29H40N8O3S
Molecular Weight:
580.76
AlogP:
3.77
PSA:
115.82
HBD:
2.0
HBA:
#RotB:
9.0
Source:
BALAMAPIMOD
(1)
Small molecule
Dual specificity mitogen-activated protein kinase kinase 1 inhibitor
Unknown
Investigational
Unknown
BALAMAPIMOD
×
Maximum Phase:
1
First Approval:
None
UNII:
7Y0IV7N95Q
Molecule Type:
Small molecule
Molecular Formula:
C30H32ClN7OS
Molecular Weight:
574.15
AlogP:
6.46
PSA:
82.24
HBD:
1.0
HBA:
#RotB:
7.0
Source:
PALOMID-529
(1)
Small molecule
Serine/threonine-protein kinase mTOR inhibitor
Unknown
Investigational
Unknown
PALOMID-529
×
Maximum Phase:
1
First Approval:
None
UNII:
XV9409EWG4
Molecule Type:
Small molecule
Molecular Formula:
C24H22O6
Molecular Weight:
406.43
AlogP:
4.6
PSA:
78.13
HBD:
1.0
HBA:
#RotB:
6.0
Source:
IMD-0354
(1)
Small molecule
Inhibitor of nuclear factor kappa B kinase beta subunit inhibitor
Unknown
Investigational
Unknown
IMD-0354
×
Maximum Phase:
1
First Approval:
None
UNII:
76145IS906
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
APN1125
(1)
Small molecule
Neuronal acetylcholine receptor protein alpha-7 subunit partial agonist
Unknown
Investigational
Unknown
APN1125
×
Maximum Phase:
1
First Approval:
None
UNII:
None
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
VLX-600
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
VLX-600
×
Maximum Phase:
1
First Approval:
None
UNII:
YZO6DG19MG
Molecule Type:
Small molecule
Molecular Formula:
C17H15N7
Molecular Weight:
317.36
AlogP:
3.05
PSA:
91.74
HBD:
2.0
HBA:
#RotB:
3.0
Source:
ALETHINE
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
ALETHINE
×
Maximum Phase:
1
First Approval:
None
UNII:
LY583605Y8
Molecule Type:
Small molecule
Molecular Formula:
C10H22N4O2S2
Molecular Weight:
294.45
AlogP:
-0.7
PSA:
110.24
HBD:
4.0
HBA:
#RotB:
11.0
Source:
SOBETIROME
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
SOBETIROME
×
Maximum Phase:
1
First Approval:
None
UNII:
XQ31741E9Q
Molecule Type:
Small molecule
Molecular Formula:
C20H24O4
Molecular Weight:
328.41
AlogP:
4.19
PSA:
66.76
HBD:
2.0
HBA:
#RotB:
6.0
Source:
GSK-3179106
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
GSK-3179106
×
Maximum Phase:
1
First Approval:
None
UNII:
DY8BBK4G3C
Molecule Type:
Small molecule
Molecular Formula:
C22H21F4N3O4
Molecular Weight:
467.42
AlogP:
4.59
PSA:
97.22
HBD:
2.0
HBA:
#RotB:
7.0
Source:
NORBUPRENORPHINE
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
NORBUPRENORPHINE
×
Maximum Phase:
1
First Approval:
None
UNII:
7E53B4O073
Molecule Type:
Small molecule
Molecular Formula:
C25H35NO4
Molecular Weight:
413.56
AlogP:
3.29
PSA:
70.95
HBD:
3.0
HBA:
#RotB:
2.0
Source:
RALURIDINE
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
RALURIDINE
×
Maximum Phase:
1
First Approval:
None
UNII:
9D65NWY2K0
Molecule Type:
Small molecule
Molecular Formula:
C9H10ClFN2O4
Molecular Weight:
264.64
AlogP:
-0.19
PSA:
84.32
HBD:
2.0
HBA:
#RotB:
2.0
Source:
ATX-914
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
ATX-914
×
Maximum Phase:
1
First Approval:
None
UNII:
8VK61D7U5D
Molecule Type:
Small molecule
Molecular Formula:
C29H23BrN4O2
Molecular Weight:
539.43
AlogP:
5.95
PSA:
69.9
HBD:
0.0
HBA:
#RotB:
6.0
Source:
CHOLYLSARCOSINE
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
CHOLYLSARCOSINE
×
Maximum Phase:
1
First Approval:
None
UNII:
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
ILS-920
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
ILS-920
×
Maximum Phase:
1
First Approval:
None
UNII:
F2D5P81X82
Molecule Type:
Small molecule
Molecular Formula:
C58H88N2O14
Molecular Weight:
1037.34
AlogP:
None
PSA:
None
HBD:
None
HBA:
#RotB:
None
Source:
ASTX-660
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
ASTX-660
×
Maximum Phase:
1
First Approval:
None
UNII:
2LHZ9ZC3YO
Molecule Type:
Small molecule
Molecular Formula:
C30H42FN5O3
Molecular Weight:
539.7
AlogP:
2.31
PSA:
81.17
HBD:
2.0
HBA:
#RotB:
7.0
Source:
TAK-243
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
TAK-243
×
Maximum Phase:
1
First Approval:
None
UNII:
V9GGV0YCDI
Molecule Type:
Small molecule
Molecular Formula:
C19H20F3N5O5S2
Molecular Weight:
519.53
AlogP:
1.75
PSA:
152.07
HBD:
4.0
HBA:
#RotB:
7.0
Source:
BQ 788
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
BQ 788
×
Maximum Phase:
1
First Approval:
None
UNII:
6MB0YNA8DJ
Molecule Type:
Small molecule
Molecular Formula:
C34H51N5O7
Molecular Weight:
641.81
AlogP:
4.82
PSA:
159.07
HBD:
4.0
HBA:
#RotB:
12.0
Source:
TEDALINAB
(1)
Small molecule
Cannabinoid CB2 receptor agonist
Unknown
Investigational
Unknown
TEDALINAB
×
Maximum Phase:
1
First Approval:
None
UNII:
5R7X34Y6Q1
Molecule Type:
Small molecule
Molecular Formula:
C19H21F2N3O
Molecular Weight:
345.39
AlogP:
4.04
PSA:
46.92
HBD:
1.0
HBA:
#RotB:
2.0
Source:
MONEPANTEL
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
MONEPANTEL
×
Maximum Phase:
1
First Approval:
None
UNII:
82MA79VJ33
Molecule Type:
Small molecule
Molecular Formula:
C20H13F6N3O2S
Molecular Weight:
473.4
AlogP:
5.28
PSA:
85.91
HBD:
1.0
HBA:
#RotB:
6.0
Source:
1
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Compound Name
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Compound Properties
Molecular Formula
Molecular Weight
ALogP
PSA