Chemical
Browse
Active Pharmaceutical Ingredients
Bioactive chemicals
Agrochemicals
Search
Chemical Structure
Explore
Chemical Similarity
Transformation
Browse
Prodrugs
Drug Metabolites
Metabolite Datasets
Cytochrome P450
Homo sapiens »
CYP1
CYP2
CYP3
CYP4
CYP5
CYP7
CYP8
CYP11
CYP17
CYP19
CYP20
CYP21
CYP24
CYP26
CYP27
CYP39
CYP46
CYP51
Mus musculus
Danio rerio
Oncorhynchus mykiss
Comparison of CYPs
Biochemical Action
Browse
Target Level (ChEMBL)
Level 1
Level 2
Level 3
Level 4
Level 5
Level 6
Mechanism of action
Search
Mechanism of action
BLAST against human drug target
BLAST against selected species (UniProt)
Exposure
Browse
Monitoring data
Downloads
Web services
Bulk downloads
About
About EcoDrug+
Citing
Data Sources
FAQ
Contact Us
Versions
Display Options:
Molecule Type
Mechanism of Action
Route of Adminstration
Status
Therapeutic Indication
Number of compounds:
7959
ABT-102
(1)
Small molecule
Vanilloid receptor antagonist
Unknown
Investigational
Unknown
ABT-102
×
Maximum Phase:
1
First Approval:
None
UNII:
J0YBN3USJN
Molecule Type:
Small molecule
Molecular Formula:
C21H24N4O
Molecular Weight:
348.45
AlogP:
4.67
PSA:
69.81
HBD:
3.0
HBA:
#RotB:
2.0
Source:
TECHNETIUM TC-99M PERTECHNETATE
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
TECHNETIUM TC-99M PERTECHNETATE
×
Maximum Phase:
1
First Approval:
None
UNII:
PPP8783IQ1
Molecule Type:
Small molecule
Molecular Formula:
HO4Tc
Molecular Weight:
163.91
AlogP:
None
PSA:
None
HBD:
None
HBA:
#RotB:
None
Source:
MTI-31
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
MTI-31
×
Maximum Phase:
1
First Approval:
None
UNII:
RM15YYQ1CI
Molecule Type:
Small molecule
Molecular Formula:
C26H30N6O3
Molecular Weight:
474.57
AlogP:
2.64
PSA:
92.71
HBD:
1.0
HBA:
#RotB:
4.0
Source:
LAS101057
(1)
Small molecule
Adenosine A2b receptor antagonist
Unknown
Investigational
Unknown
LAS101057
×
Maximum Phase:
1
First Approval:
None
UNII:
3EBU6WKP85
Molecule Type:
Small molecule
Molecular Formula:
C18H14FN5O
Molecular Weight:
335.34
AlogP:
3.09
PSA:
80.66
HBD:
1.0
HBA:
#RotB:
4.0
Source:
BTZ-043
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
BTZ-043
×
Maximum Phase:
1
First Approval:
None
UNII:
G55ZH52P57
Molecule Type:
Small molecule
Molecular Formula:
C17H16F3N3O5S
Molecular Weight:
431.39
AlogP:
3.32
PSA:
94.8
HBD:
0.0
HBA:
#RotB:
2.0
Source:
RO-5028442
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
RO-5028442
×
Maximum Phase:
1
First Approval:
None
UNII:
LZ0EU1YHCK
Molecule Type:
Small molecule
Molecular Formula:
C25H28ClN3O2
Molecular Weight:
437.97
AlogP:
4.52
PSA:
37.71
HBD:
0.0
HBA:
#RotB:
4.0
Source:
LY-2811376
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
LY-2811376
×
Maximum Phase:
1
First Approval:
None
UNII:
UR18YJ97SJ
Molecule Type:
Small molecule
Molecular Formula:
C15H14F2N4S
Molecular Weight:
320.37
AlogP:
3.09
PSA:
64.16
HBD:
1.0
HBA:
#RotB:
2.0
Source:
QUEMLICLUSTAT
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
QUEMLICLUSTAT
×
Maximum Phase:
1
First Approval:
None
UNII:
J6K8WSV73A
Molecule Type:
Small molecule
Molecular Formula:
C20H24ClFN4O9P2
Molecular Weight:
580.83
AlogP:
2.35
PSA:
196.49
HBD:
6.0
HBA:
#RotB:
9.0
Source:
IRSOGLADINE
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
IRSOGLADINE
×
Maximum Phase:
1
First Approval:
None
UNII:
QBX79NZC1D
Molecule Type:
Small molecule
Molecular Formula:
C9H7Cl2N5
Molecular Weight:
256.1
AlogP:
2.01
PSA:
90.71
HBD:
2.0
HBA:
#RotB:
1.0
Source:
MAVATREP
(1)
Small molecule
Vanilloid receptor antagonist
Unknown
Investigational
Unknown
MAVATREP
×
Maximum Phase:
1
First Approval:
None
UNII:
F197218T99
Molecule Type:
Small molecule
Molecular Formula:
C25H21F3N2O
Molecular Weight:
422.45
AlogP:
6.65
PSA:
48.91
HBD:
2.0
HBA:
#RotB:
4.0
Source:
NEDISERTIB
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
NEDISERTIB
×
Maximum Phase:
1
First Approval:
None
UNII:
GN429E725A
Molecule Type:
Small molecule
Molecular Formula:
C24H21ClFN5O3
Molecular Weight:
481.92
AlogP:
3.81
PSA:
93.49
HBD:
1.0
HBA:
#RotB:
5.0
Source:
LY-2584702
(1)
Small molecule
Ribosomal protein S6 kinase 1 inhibitor
Unknown
Investigational
Unknown
LY-2584702
×
Maximum Phase:
1
First Approval:
None
UNII:
I4965C6W4O
Molecule Type:
Small molecule
Molecular Formula:
C21H19F4N7
Molecular Weight:
445.42
AlogP:
4.3
PSA:
75.52
HBD:
1.0
HBA:
#RotB:
3.0
Source:
PIPERAQUINE TETRAPHOSPHATE
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
PIPERAQUINE TETRAPHOSPHATE
×
Maximum Phase:
1
First Approval:
None
UNII:
IHB5WLO51Q
Molecule Type:
Small molecule
Molecular Formula:
C29H44Cl2N6O16P4
Molecular Weight:
927.5
AlogP:
5.42
PSA:
38.74
HBD:
0.0
HBA:
#RotB:
6.0
Source:
UK-396,082
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
UK-396,082
×
Maximum Phase:
1
First Approval:
None
UNII:
2Q5861SUIG
Molecule Type:
Small molecule
Molecular Formula:
C12H21N3O2
Molecular Weight:
239.32
AlogP:
1.28
PSA:
81.14
HBD:
2.0
HBA:
#RotB:
8.0
Source:
TRODUSQUEMINE
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
TRODUSQUEMINE
×
Maximum Phase:
1
First Approval:
None
UNII:
KKC12PIF16
Molecule Type:
Small molecule
Molecular Formula:
C37H72N4O5S
Molecular Weight:
685.07
AlogP:
5.53
PSA:
145.94
HBD:
6.0
HBA:
#RotB:
20.0
Source:
ASP-5878
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
ASP-5878
×
Maximum Phase:
1
First Approval:
None
UNII:
C0Z095LL72
Molecule Type:
Small molecule
Molecular Formula:
C18H19F2N5O4
Molecular Weight:
407.38
AlogP:
2.28
PSA:
103.55
HBD:
2.0
HBA:
#RotB:
9.0
Source:
METHOXYAMINE HYDROCHLORIDE
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
METHOXYAMINE HYDROCHLORIDE
×
Maximum Phase:
1
First Approval:
None
UNII:
203546OLMF
Molecule Type:
Small molecule
Molecular Formula:
CH6ClNO
Molecular Weight:
83.52
AlogP:
-0.49
PSA:
35.25
HBD:
1.0
HBA:
#RotB:
0.0
Source:
XL-228
(1)
Small molecule
Insulin-like growth factor I receptor inhibitor
Unknown
Investigational
Unknown
XL-228
×
Maximum Phase:
1
First Approval:
None
UNII:
33M2XSK003
Molecule Type:
Small molecule
Molecular Formula:
C22H31N9O
Molecular Weight:
437.55
AlogP:
3.3
PSA:
111.03
HBD:
3.0
HBA:
#RotB:
8.0
Source:
DEFERITRIN
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
DEFERITRIN
×
Maximum Phase:
1
First Approval:
None
UNII:
T69Y9LDN44
Molecule Type:
Small molecule
Molecular Formula:
C11H11NO4S
Molecular Weight:
253.28
AlogP:
1.43
PSA:
90.12
HBD:
3.0
HBA:
#RotB:
2.0
Source:
E-7130
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
E-7130
×
Maximum Phase:
1
First Approval:
None
UNII:
R6WE4X56YH
Molecule Type:
Small molecule
Molecular Formula:
C58H83NO17
Molecular Weight:
1066.29
AlogP:
None
PSA:
None
HBD:
None
HBA:
#RotB:
None
Source:
PF-03382792
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
PF-03382792
×
Maximum Phase:
1
First Approval:
None
UNII:
QPE81T4KH0
Molecule Type:
Small molecule
Molecular Formula:
C23H32FN3O4
Molecular Weight:
433.52
AlogP:
2.41
PSA:
82.11
HBD:
2.0
HBA:
#RotB:
4.0
Source:
GSK-610677
(1)
Small molecule
MAP kinase p38 alpha inhibitor
Unknown
Investigational
Unknown
GSK-610677
×
Maximum Phase:
1
First Approval:
None
UNII:
None
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
AZD-5438
(1)
Small molecule
Cyclin-dependent kinase inhibitor
Unknown
Investigational
Unknown
AZD-5438
×
Maximum Phase:
1
First Approval:
None
UNII:
276Z913G29
Molecule Type:
Small molecule
Molecular Formula:
C18H21N5O2S
Molecular Weight:
371.47
AlogP:
3.38
PSA:
89.77
HBD:
1.0
HBA:
#RotB:
5.0
Source:
ELTANEXOR
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
ELTANEXOR
×
Maximum Phase:
1
First Approval:
None
UNII:
Q59IQJ9NTK
Molecule Type:
Small molecule
Molecular Formula:
C17H10F6N6O
Molecular Weight:
428.3
AlogP:
3.26
PSA:
99.58
HBD:
1.0
HBA:
#RotB:
4.0
Source:
DANIQUIDONE
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
DANIQUIDONE
×
Maximum Phase:
1
First Approval:
None
UNII:
E780TX33D2
Molecule Type:
Small molecule
Molecular Formula:
C15H11N3O
Molecular Weight:
249.27
AlogP:
2.32
PSA:
58.69
HBD:
1.0
HBA:
#RotB:
0.0
Source:
BARDOXOLONE
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
BARDOXOLONE
×
Maximum Phase:
1
First Approval:
None
UNII:
7HT68L8941
Molecule Type:
Small molecule
Molecular Formula:
C31H41NO4
Molecular Weight:
491.67
AlogP:
6.29
PSA:
95.23
HBD:
1.0
HBA:
#RotB:
1.0
Source:
RG-1530
(1)
Small molecule
Fibroblast growth factor receptor 1 inhibitor
Unknown
Investigational
Unknown
RG-1530
×
Maximum Phase:
1
First Approval:
None
UNII:
XQJ55R5PPQ
Molecule Type:
Small molecule
Molecular Formula:
C18H14ClFN4O
Molecular Weight:
356.79
AlogP:
4.75
PSA:
62.3
HBD:
2.0
HBA:
#RotB:
2.0
Source:
GS 6201
(1)
Small molecule
Adenosine A2b receptor antagonist
Unknown
Investigational
Unknown
GS 6201
×
Maximum Phase:
1
First Approval:
None
UNII:
67CKV7X08G
Molecule Type:
Small molecule
Molecular Formula:
C21H21F3N6O2
Molecular Weight:
446.43
AlogP:
3.25
PSA:
90.5
HBD:
1.0
HBA:
#RotB:
6.0
Source:
COH-29
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
COH-29
×
Maximum Phase:
1
First Approval:
None
UNII:
07802BU06S
Molecule Type:
Small molecule
Molecular Formula:
C22H16N2O5S
Molecular Weight:
420.45
AlogP:
4.55
PSA:
122.91
HBD:
5.0
HBA:
#RotB:
4.0
Source:
MIRODENAFIL
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
MIRODENAFIL
×
Maximum Phase:
1
First Approval:
None
UNII:
504G362H0H
Molecule Type:
Small molecule
Molecular Formula:
C26H37N5O5S
Molecular Weight:
531.68
AlogP:
2.45
PSA:
120.76
HBD:
2.0
HBA:
#RotB:
11.0
Source:
TAS-115
(1)
Small molecule
Hepatocyte growth factor receptor inhibitor
Unknown
Investigational
Unknown
TAS-115
×
Maximum Phase:
1
First Approval:
None
UNII:
H2OL3Q4XRD
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
ITX-5061
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
ITX-5061
×
Maximum Phase:
1
First Approval:
None
UNII:
J4RA8K2Q2A
Molecule Type:
Small molecule
Molecular Formula:
C30H38ClN3O7S
Molecular Weight:
620.17
AlogP:
4.05
PSA:
123.27
HBD:
2.0
HBA:
#RotB:
10.0
Source:
AZD-8075
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
AZD-8075
×
Maximum Phase:
1
First Approval:
None
UNII:
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
ABTL-0812
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
ABTL-0812
×
Maximum Phase:
1
First Approval:
None
UNII:
0DE74TJ7EZ
Molecule Type:
Small molecule
Molecular Formula:
C18H32O3
Molecular Weight:
296.45
AlogP:
4.86
PSA:
57.53
HBD:
2.0
HBA:
#RotB:
14.0
Source:
CPI-1205
(1)
Small molecule
Unknown
Unknown
Investigational
Unknown
CPI-1205
×
Maximum Phase:
1
First Approval:
None
UNII:
455J2479FY
Molecule Type:
Small molecule
Molecular Formula:
C27H33F3N4O3
Molecular Weight:
518.58
AlogP:
4.72
PSA:
79.36
HBD:
2.0
HBA:
#RotB:
7.0
Source:
TERAMEPROCOL
(1)
Small molecule
DNA inhibitor
Unknown
Investigational
Unknown
TERAMEPROCOL
×
Maximum Phase:
1
First Approval:
None
UNII:
53YET703F2
Molecule Type:
Small molecule
Molecular Formula:
C22H30O4
Molecular Weight:
358.48
AlogP:
4.78
PSA:
36.92
HBD:
0.0
HBA:
#RotB:
9.0
Source:
1
2
…
120
121
122
123
124
125
126
…
221
222
Next »
Download Option
Header
Compound Name
Maximum Phase
Compound Structure
Smile
Inchi
InchiKey
Compound Properties
Molecular Formula
Molecular Weight
ALogP
PSA