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Display Options:
Molecule Type
Mechanism of Action
Route of Adminstration
Status
Therapeutic Indication
Number of compounds:
7959
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:
PLX-7486
(1)
Small molecule
Macrophage colony stimulating factor receptor inhibitor
Unknown
Investigational
Unknown
PLX-7486
×
Maximum Phase:
1
First Approval:
None
UNII:
None
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
SELITRECTINIB
(1)
Small molecule
Neurotrophic tyrosine kinase receptor inhibitor
Unknown
Investigational
Unknown
SELITRECTINIB
×
Maximum Phase:
1
First Approval:
None
UNII:
0J45910S3X
Molecule Type:
Small molecule
Molecular Formula:
C20H21FN6O
Molecular Weight:
380.43
AlogP:
2.67
PSA:
75.42
HBD:
1.0
HBA:
#RotB:
0.0
Source:
AMMONIUM TETRATHIOMOLYBDATE
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
AMMONIUM TETRATHIOMOLYBDATE
×
Maximum Phase:
1
First Approval:
None
UNII:
4V6I63LW1E
Molecule Type:
Small molecule
Molecular Formula:
H8MoN2S4
Molecular Weight:
260.29
AlogP:
None
PSA:
None
HBD:
None
HBA:
#RotB:
None
Source:
TEGLARINAD CHLORIDE
(1)
Small molecule
Nicotinamide phosphoribosyltransferase inhibitor
Unknown
Investigational
Unknown
TEGLARINAD CHLORIDE
×
Maximum Phase:
1
First Approval:
None
UNII:
D6V5QYX9MZ
Molecule Type:
Small molecule
Molecular Formula:
C30H43Cl2N5O8
Molecular Weight:
672.61
AlogP:
3.91
PSA:
145.77
HBD:
2.0
HBA:
#RotB:
23.0
Source:
PF-04455242
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
PF-04455242
×
Maximum Phase:
1
First Approval:
None
UNII:
Y3530Z78QD
Molecule Type:
Small molecule
Molecular Formula:
C21H28N2O2S
Molecular Weight:
372.53
AlogP:
3.88
PSA:
49.41
HBD:
1.0
HBA:
#RotB:
7.0
Source:
METHANESULFONYL FLUORIDE
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
METHANESULFONYL FLUORIDE
×
Maximum Phase:
1
First Approval:
None
UNII:
9H250YYY0R
Molecule Type:
Small molecule
Molecular Formula:
CH3FO2S
Molecular Weight:
98.1
AlogP:
-0.08
PSA:
34.14
HBD:
0.0
HBA:
#RotB:
0.0
Source:
HYDROXYNORKETAMINE, (2R,6R)
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
HYDROXYNORKETAMINE, (2R,6R)
×
Maximum Phase:
1
First Approval:
None
UNII:
None
Molecule Type:
Small molecule
Molecular Formula:
C12H14ClNO2
Molecular Weight:
239.7
AlogP:
1.61
PSA:
63.32
HBD:
2.0
HBA:
#RotB:
1.0
Source:
BIAPENEM
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
BIAPENEM
×
Maximum Phase:
1
First Approval:
None
UNII:
YR5U3L9ZH1
Molecule Type:
Small molecule
Molecular Formula:
C15H18N4O4S
Molecular Weight:
350.4
AlogP:
-1.89
PSA:
102.37
HBD:
1.0
HBA:
#RotB:
4.0
Source:
ODM-207
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
ODM-207
×
Maximum Phase:
1
First Approval:
None
UNII:
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
BTA-9881
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
BTA-9881
×
Maximum Phase:
1
First Approval:
None
UNII:
9VR1J6U4XG
Molecule Type:
Small molecule
Molecular Formula:
C21H15ClN4O2
Molecular Weight:
390.83
AlogP:
2.94
PSA:
66.4
HBD:
0.0
HBA:
#RotB:
2.0
Source:
E-2212
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
E-2212
×
Maximum Phase:
1
First Approval:
None
UNII:
V9KGF25853
Molecule Type:
Small molecule
Molecular Formula:
C25H23F3N6O
Molecular Weight:
480.49
AlogP:
5.29
PSA:
70.65
HBD:
0.0
HBA:
#RotB:
5.0
Source:
D6-25-HYDROXYVITAMIN D3
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
D6-25-HYDROXYVITAMIN D3
×
Maximum Phase:
1
First Approval:
None
UNII:
378HY809HV
Molecule Type:
Small molecule
Molecular Formula:
C27H44O2
Molecular Weight:
406.68
AlogP:
6.73
PSA:
40.46
HBD:
2.0
HBA:
#RotB:
6.0
Source:
BMS-791826
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
BMS-791826
×
Maximum Phase:
1
First Approval:
None
UNII:
60BN6CDL0K
Molecule Type:
Small molecule
Molecular Formula:
C28H26FN5O3S
Molecular Weight:
531.61
AlogP:
5.73
PSA:
97.31
HBD:
1.0
HBA:
#RotB:
6.0
Source:
SLC-391
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
SLC-391
×
Maximum Phase:
1
First Approval:
None
UNII:
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
MAFOSFAMIDE
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
MAFOSFAMIDE
×
Maximum Phase:
1
First Approval:
None
UNII:
5970HH9923
Molecule Type:
Small molecule
Molecular Formula:
C9H19Cl2N2O5PS2
Molecular Weight:
401.27
AlogP:
1.83
PSA:
95.94
HBD:
2.0
HBA:
#RotB:
9.0
Source:
GS-9667
(1)
Small molecule
Adenosine A1 receptor partial agonist
Unknown
Investigational
Unknown
GS-9667
×
Maximum Phase:
1
First Approval:
None
UNII:
6E68796C40
Molecule Type:
Small molecule
Molecular Formula:
C21H24FN5O4S
Molecular Weight:
461.52
AlogP:
1.7
PSA:
125.55
HBD:
4.0
HBA:
#RotB:
6.0
Source:
PF-04418948
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
PF-04418948
×
Maximum Phase:
1
First Approval:
None
UNII:
I7Z38E70VF
Molecule Type:
Small molecule
Molecular Formula:
C23H20FNO5
Molecular Weight:
409.41
AlogP:
3.59
PSA:
76.07
HBD:
1.0
HBA:
#RotB:
6.0
Source:
AMG-517
(1)
Small molecule
Vanilloid receptor antagonist
Unknown
Investigational
Unknown
AMG-517
×
Maximum Phase:
1
First Approval:
None
UNII:
172V4FBZ75
Molecule Type:
Small molecule
Molecular Formula:
C20H13F3N4O2S
Molecular Weight:
430.41
AlogP:
5.52
PSA:
77.0
HBD:
1.0
HBA:
#RotB:
4.0
Source:
PFK-158
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
PFK-158
×
Maximum Phase:
1
First Approval:
None
UNII:
2HOK1JQ203
Molecule Type:
Small molecule
Molecular Formula:
C18H11F3N2O
Molecular Weight:
328.29
AlogP:
4.54
PSA:
42.85
HBD:
0.0
HBA:
#RotB:
3.0
Source:
BRICICLIB
(1)
Small molecule
G1/S-specific cyclin D1 inhibitor
Unknown
Investigational
Unknown
BRICICLIB
×
Maximum Phase:
1
First Approval:
None
UNII:
WG93X96336
Molecule Type:
Small molecule
Molecular Formula:
C19H23O10PS
Molecular Weight:
474.42
AlogP:
2.78
PSA:
137.82
HBD:
2.0
HBA:
#RotB:
10.0
Source:
CP-459632
(1)
Small molecule
Fibroblast growth factor receptor inhibitor
Unknown
Investigational
Unknown
CP-459632
×
Maximum Phase:
1
First Approval:
None
UNII:
None
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
ASN007
(1)
Small molecule
Mitogen-activated protein kinase; ERK1/ERK2 inhibitor
Unknown
Investigational
Unknown
ASN007
×
Maximum Phase:
1
First Approval:
None
UNII:
6EEK33O4O4
Molecule Type:
Small molecule
Molecular Formula:
C22H25ClFN7O2
Molecular Weight:
473.94
AlogP:
2.78
PSA:
119.98
HBD:
3.0
HBA:
#RotB:
7.0
Source:
THIARABINE
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
THIARABINE
×
Maximum Phase:
1
First Approval:
None
UNII:
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
TRANSTORINE
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
TRANSTORINE
×
Maximum Phase:
1
First Approval:
None
UNII:
H030S2S85J
Molecule Type:
Small molecule
Molecular Formula:
C10H7NO3
Molecular Weight:
189.17
AlogP:
1.23
PSA:
70.16
HBD:
2.0
HBA:
#RotB:
1.0
Source:
DELANZOMIB
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
DELANZOMIB
×
Maximum Phase:
1
First Approval:
None
UNII:
6IF28942WO
Molecule Type:
Small molecule
Molecular Formula:
C21H28BN3O5
Molecular Weight:
413.28
AlogP:
None
PSA:
None
HBD:
None
HBA:
#RotB:
None
Source:
E7107
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
E7107
×
Maximum Phase:
1
First Approval:
None
UNII:
R60DZX1E2N
Molecule Type:
Small molecule
Molecular Formula:
C40H66N2O9
Molecular Weight:
718.97
AlogP:
5.05
PSA:
152.53
HBD:
4.0
HBA:
#RotB:
10.0
Source:
PIMAGEDINE
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
PIMAGEDINE
×
Maximum Phase:
1
First Approval:
None
UNII:
SCQ4EZQ113
Molecule Type:
Small molecule
Molecular Formula:
CH6N4
Molecular Weight:
74.09
AlogP:
-1.87
PSA:
90.42
HBD:
3.0
HBA:
#RotB:
0.0
Source:
LEVOMENOL
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
LEVOMENOL
×
Maximum Phase:
1
First Approval:
None
UNII:
24WE03BX2T
Molecule Type:
Small molecule
Molecular Formula:
C15H26O
Molecular Weight:
222.37
AlogP:
4.23
PSA:
20.23
HBD:
1.0
HBA:
#RotB:
4.0
Source:
NUMIDARGISTAT
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
NUMIDARGISTAT
×
Maximum Phase:
1
First Approval:
None
UNII:
IFD73D535A
Molecule Type:
Small molecule
Molecular Formula:
C11H22BN3O5
Molecular Weight:
287.12
AlogP:
None
PSA:
None
HBD:
None
HBA:
#RotB:
None
Source:
GSK-369796
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
GSK-369796
×
Maximum Phase:
1
First Approval:
None
UNII:
NSC8QP4B6Z
Molecule Type:
Small molecule
Molecular Formula:
C20H22ClN3O
Molecular Weight:
355.87
AlogP:
5.23
PSA:
57.18
HBD:
3.0
HBA:
#RotB:
4.0
Source:
PS-516895
(1)
Small molecule
MAP kinase p38 alpha inhibitor
Unknown
Investigational
Unknown
PS-516895
×
Maximum Phase:
1
First Approval:
None
UNII:
None
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
GSK-923295A
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
GSK-923295A
×
Maximum Phase:
1
First Approval:
None
UNII:
072702W9QD
Molecule Type:
Small molecule
Molecular Formula:
C32H38ClN5O4
Molecular Weight:
592.14
AlogP:
4.51
PSA:
108.2
HBD:
3.0
HBA:
#RotB:
12.0
Source:
GET-73
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
GET-73
×
Maximum Phase:
1
First Approval:
None
UNII:
U5CLZ223FH
Molecule Type:
Small molecule
Molecular Formula:
C13H16F3NO2
Molecular Weight:
275.27
AlogP:
2.75
PSA:
38.33
HBD:
1.0
HBA:
#RotB:
6.0
Source:
BMS-817378
(1)
Small molecule
Hepatocyte growth factor receptor inhibitor
Unknown
Investigational
Unknown
BMS-817378
×
Maximum Phase:
1
First Approval:
None
UNII:
None
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
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:
1
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Molecular Formula
Molecular Weight
ALogP
PSA