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Display Options:
Molecule Type
Mechanism of Action
Route of Adminstration
Status
Therapeutic Indication
Number of compounds:
7959
VORAPAXAR
(2014)
Small molecule
Unknown
Unknown
Approved
Thrombosis
VORAPAXAR
×
Maximum Phase:
4
First Approval:
2014
UNII:
ZCE93644N2
Molecule Type:
Small molecule
Molecular Formula:
C29H33FN2O4
Molecular Weight:
492.59
AlogP:
5.63
PSA:
77.52
HBD:
1.0
HBA:
#RotB:
5.0
Source:
OLAPARIB
(2014)
Small molecule
PARP 1, 2 and 3 inhibitor
ORAL
Approved
Neoplasms; Ovarian Neoplasms
OLAPARIB
×
Maximum Phase:
4
First Approval:
2014
UNII:
WOH1JD9AR8
Molecule Type:
Small molecule
Molecular Formula:
C24H23FN4O3
Molecular Weight:
434.47
AlogP:
2.35
PSA:
86.37
HBD:
1.0
HBA:
#RotB:
4.0
Source:
OLODATEROL
(2014)
Small molecule
Unknown
Unknown
Approved
Lung Diseases, Obstructive
OLODATEROL
×
Maximum Phase:
4
First Approval:
2014
UNII:
VD2YSN1AFD
Molecule Type:
Small molecule
Molecular Formula:
C21H26N2O5
Molecular Weight:
386.45
AlogP:
2.38
PSA:
100.05
HBD:
4.0
HBA:
#RotB:
7.0
Source:
TEDIZOLID PHOSPHATE
(2014)
Small molecule
Bacterial 70S ribosome inhibitor
INTRAVENOUS; ORAL
Approved
Unknown
TEDIZOLID PHOSPHATE
×
Maximum Phase:
4
First Approval:
2014
UNII:
O7DRJ6R4DW
Molecule Type:
Small molecule
Molecular Formula:
C17H16FN6O6P
Molecular Weight:
450.32
AlogP:
1.51
PSA:
152.79
HBD:
2.0
HBA:
#RotB:
6.0
Source:
IDELALISIB
(2014)
Small molecule
PI3-kinase p110-delta subunit inhibitor
ORAL
Approved
Leukemia, Lymphocytic, Chronic, B-Cell; Lymphoma, Non-Hodgkin; Neoplasms
IDELALISIB
×
Maximum Phase:
4
First Approval:
2014
UNII:
YG57I8T5M0
Molecule Type:
Small molecule
Molecular Formula:
C22H18FN7O
Molecular Weight:
415.43
AlogP:
3.75
PSA:
101.38
HBD:
2.0
HBA:
#RotB:
5.0
Source:
ELIGLUSTAT
(2014)
Small molecule
Unknown
Unknown
Approved
Unknown
ELIGLUSTAT
×
Maximum Phase:
4
First Approval:
2014
UNII:
DR40J4WA67
Molecule Type:
Small molecule
Molecular Formula:
C23H36N2O4
Molecular Weight:
404.55
AlogP:
3.43
PSA:
71.03
HBD:
2.0
HBA:
#RotB:
11.0
Source:
CEFTOLOZANE SULFATE
(2014)
Small molecule
Bacterial penicillin-binding protein inhibitor
Unknown
Approved
Intraabdominal Infections; Urinary Tract Infections
CEFTOLOZANE SULFATE
×
Maximum Phase:
4
First Approval:
2014
UNII:
7R247U84HY
Molecule Type:
Small molecule
Molecular Formula:
C23H32N12O12S3
Molecular Weight:
764.78
AlogP:
-3.9
PSA:
302.21
HBD:
7.0
HBA:
#RotB:
12.0
Source:
ELIGLUSTAT TARTRATE
(2014)
Small molecule
Ceramide glucosyltransferase inhibitor
ORAL
Approved
Gaucher Disease
ELIGLUSTAT TARTRATE
×
Maximum Phase:
4
First Approval:
2014
UNII:
N0493335P3
Molecule Type:
Small molecule
Molecular Formula:
C50H78N4O14
Molecular Weight:
959.19
AlogP:
3.43
PSA:
71.03
HBD:
2.0
HBA:
#RotB:
11.0
Source:
TENOFOVIR ALAFENAMIDE FUMARATE
(2015)
Small molecule
Human immunodeficiency virus type 1 reverse transcriptase inhibitor
ORAL
Approved
HIV Infections; Hepatitis B, Chronic
TENOFOVIR ALAFENAMIDE FUMARATE
×
Maximum Phase:
4
First Approval:
2015
UNII:
FWF6Q91TZO
Molecule Type:
Small molecule
Molecular Formula:
C46H62N12O14P2
Molecular Weight:
1069.02
AlogP:
2.97
PSA:
143.48
HBD:
2.0
HBA:
#RotB:
11.0
Source:
ALECTINIB
(2015)
Small molecule
Unknown
Unknown
Approved
Neoplasms
ALECTINIB
×
Maximum Phase:
4
First Approval:
2015
UNII:
LIJ4CT1Z3Y
Molecule Type:
Small molecule
Molecular Formula:
C30H34N4O2
Molecular Weight:
482.63
AlogP:
4.77
PSA:
72.36
HBD:
1.0
HBA:
#RotB:
3.0
Source:
CARIPRAZINE HYDROCHLORIDE
(2015)
Small molecule
Dopamine D2 receptor modulator
ORAL
Approved
Bipolar Disorder; Schizophrenia
CARIPRAZINE HYDROCHLORIDE
×
Maximum Phase:
4
First Approval:
2015
UNII:
KQD7C255YG
Molecule Type:
Small molecule
Molecular Formula:
C21H33Cl3N4O
Molecular Weight:
463.88
AlogP:
4.34
PSA:
38.82
HBD:
1.0
HBA:
#RotB:
5.0
Source:
SONIDEGIB PHOSPHATE
(2015)
Small molecule
Smoothened homolog inhibitor
ORAL
Approved
Carcinoma, Basal Cell
SONIDEGIB PHOSPHATE
×
Maximum Phase:
4
First Approval:
2015
UNII:
W421AI34UW
Molecule Type:
Small molecule
Molecular Formula:
C26H32F3N3O11P2
Molecular Weight:
681.49
AlogP:
5.82
PSA:
63.69
HBD:
1.0
HBA:
#RotB:
5.0
Source:
AVIBACTAM
(2015)
Small molecule
Unknown
Unknown
Approved
Unknown
AVIBACTAM
×
Maximum Phase:
4
First Approval:
2015
UNII:
06MFO7817I
Molecule Type:
Small molecule
Molecular Formula:
C7H11N3O6S
Molecular Weight:
265.25
AlogP:
-1.53
PSA:
130.24
HBD:
2.0
HBA:
#RotB:
3.0
Source:
DACLATASVIR DIHYDROCHLORIDE
(2015)
Small molecule
Nonstructural protein 5A inhibitor
Unknown
Approved
Hepatitis C, Chronic
DACLATASVIR DIHYDROCHLORIDE
×
Maximum Phase:
4
First Approval:
2015
UNII:
50ZO25C11D
Molecule Type:
Small molecule
Molecular Formula:
C40H52Cl2N8O6
Molecular Weight:
811.81
AlogP:
6.22
PSA:
174.64
HBD:
4.0
HBA:
#RotB:
11.0
Source:
AMPHETAMINE ASPARTATE/DEXTROAMPHETAMINE SULFATE
(2015)
Small molecule
Unknown
Unknown
Approved
Unknown
AMPHETAMINE ASPARTATE/DEXTROAMPHETAMINE SULFATE
×
Maximum Phase:
4
First Approval:
2015
UNII:
Molecule Type:
Small molecule
Molecular Formula:
Molecular Weight:
AlogP:
PSA:
HBD:
HBA:
#RotB:
Source:
FLIBANSERIN
(2015)
Small molecule
Unknown
ORAL
Approved
Sexual Dysfunctions, Psychological
FLIBANSERIN
×
Maximum Phase:
4
First Approval:
2015
UNII:
37JK4STR6Z
Molecule Type:
Small molecule
Molecular Formula:
C20H21F3N4O
Molecular Weight:
390.41
AlogP:
3.17
PSA:
44.27
HBD:
1.0
HBA:
#RotB:
4.0
Source:
ARIPIPRAZOLE LAUROXIL
(2015)
Small molecule
Dopamine D2 receptor partial agonist
INTRAMUSCULAR
Approved
Autistic Disorder; Bipolar Disorder; Depressive Disorder, Major; Schizophrenia; Tourette Syndrome
ARIPIPRAZOLE LAUROXIL
×
Maximum Phase:
4
First Approval:
2015
UNII:
B786J7A343
Molecule Type:
Small molecule
Molecular Formula:
C36H51Cl2N3O4
Molecular Weight:
660.73
AlogP:
8.68
PSA:
62.32
HBD:
0.0
HBA:
#RotB:
19.0
Source:
DACLATASVIR
(2015)
Small molecule
Unknown
Unknown
Approved
Virus Diseases
DACLATASVIR
×
Maximum Phase:
4
First Approval:
2015
UNII:
LI2427F9CI
Molecule Type:
Small molecule
Molecular Formula:
C40H50N8O6
Molecular Weight:
738.89
AlogP:
6.22
PSA:
174.64
HBD:
4.0
HBA:
#RotB:
11.0
Source:
ALECTINIB HYDROCHLORIDE
(2015)
Small molecule
ALK tyrosine kinase receptor inhibitor
ORAL
Approved
Carcinoma, Non-Small-Cell Lung
ALECTINIB HYDROCHLORIDE
×
Maximum Phase:
4
First Approval:
2015
UNII:
P9YY73LO6J
Molecule Type:
Small molecule
Molecular Formula:
C30H35ClN4O2
Molecular Weight:
519.09
AlogP:
4.77
PSA:
72.36
HBD:
1.0
HBA:
#RotB:
3.0
Source:
ELUXADOLINE
(2015)
Small molecule
Mu opioid receptor agonist
ORAL
Approved
Irritable Bowel Syndrome
ELUXADOLINE
×
Maximum Phase:
4
First Approval:
2015
UNII:
45TPJ4MBQ1
Molecule Type:
Small molecule
Molecular Formula:
C32H35N5O5
Molecular Weight:
569.66
AlogP:
4.16
PSA:
164.63
HBD:
4.0
HBA:
#RotB:
11.0
Source:
CANGRELOR
(2015)
Small molecule
Unknown
INTRAVENOUS
Approved
Thrombosis
CANGRELOR
×
Maximum Phase:
4
First Approval:
2015
UNII:
6AQ1Y404U7
Molecule Type:
Small molecule
Molecular Formula:
C17H25Cl2F3N5O12P3S2
Molecular Weight:
776.37
AlogP:
2.85
PSA:
255.91
HBD:
7.0
HBA:
#RotB:
15.0
Source:
URIDINE TRIACETATE
(2015)
Small molecule
Unknown
ORAL
Approved
Unknown
URIDINE TRIACETATE
×
Maximum Phase:
4
First Approval:
2015
UNII:
2WP61F175M
Molecule Type:
Small molecule
Molecular Formula:
C15H18N2O9
Molecular Weight:
370.31
AlogP:
-1.14
PSA:
142.99
HBD:
1.0
HBA:
#RotB:
5.0
Source:
LESINURAD
(2015)
Small molecule
Solute carrier family 22 member 12 inhibitor
ORAL
Approved
Gout; Hyperuricemia
LESINURAD
×
Maximum Phase:
4
First Approval:
2015
UNII:
09ERP08I3W
Molecule Type:
Small molecule
Molecular Formula:
C17H14BrN3O2S
Molecular Weight:
404.29
AlogP:
4.24
PSA:
68.01
HBD:
1.0
HBA:
#RotB:
5.0
Source:
SONIDEGIB
(2015)
Small molecule
Unknown
Unknown
Approved
Neoplasms
SONIDEGIB
×
Maximum Phase:
4
First Approval:
2015
UNII:
0RLU3VTK5M
Molecule Type:
Small molecule
Molecular Formula:
C26H26F3N3O3
Molecular Weight:
485.51
AlogP:
5.82
PSA:
63.69
HBD:
1.0
HBA:
#RotB:
5.0
Source:
OSIMERTINIB MESYLATE
(2015)
Small molecule
Epidermal growth factor receptor erbB1 inhibitor
Unknown
Approved
Carcinoma, Non-Small-Cell Lung
OSIMERTINIB MESYLATE
×
Maximum Phase:
4
First Approval:
2015
UNII:
RDL94R2A16
Molecule Type:
Small molecule
Molecular Formula:
C29H37N7O5S
Molecular Weight:
595.73
AlogP:
4.51
PSA:
87.55
HBD:
2.0
HBA:
#RotB:
10.0
Source:
PANOBINOSTAT
(2015)
Small molecule
Unknown
Unknown
Approved
Neoplasms
PANOBINOSTAT
×
Maximum Phase:
4
First Approval:
2015
UNII:
9647FM7Y3Z
Molecule Type:
Small molecule
Molecular Formula:
C21H23N3O2
Molecular Weight:
349.43
AlogP:
3.33
PSA:
77.15
HBD:
4.0
HBA:
#RotB:
7.0
Source:
IVABRADINE
(2015)
Small molecule
Potassium/sodium hyperpolarization-activated cyclic nucleotide-gated channel 4 blocker
ORAL
Approved
Cardiovascular Diseases
IVABRADINE
×
Maximum Phase:
4
First Approval:
2015
UNII:
3H48L0LPZQ
Molecule Type:
Small molecule
Molecular Formula:
C27H36N2O5
Molecular Weight:
468.59
AlogP:
3.31
PSA:
60.47
HBD:
0.0
HBA:
#RotB:
10.0
Source:
SACUBITRIL
(2015)
Small molecule
Neprilysin inhibitor
Unknown
Approved
Heart Failure
SACUBITRIL
×
Maximum Phase:
4
First Approval:
2015
UNII:
17ERJ0MKGI
Molecule Type:
Small molecule
Molecular Formula:
C24H29NO5
Molecular Weight:
411.5
AlogP:
3.84
PSA:
92.7
HBD:
2.0
HBA:
#RotB:
11.0
Source:
ROLAPITANT
(2015)
Small molecule
Unknown
Unknown
Approved
Nausea
ROLAPITANT
×
Maximum Phase:
4
First Approval:
2015
UNII:
NLE429IZUC
Molecule Type:
Small molecule
Molecular Formula:
C25H26F6N2O2
Molecular Weight:
500.48
AlogP:
5.73
PSA:
50.36
HBD:
2.0
HBA:
#RotB:
5.0
Source:
COBIMETINIB
(2015)
Small molecule
Dual specificity mitogen-activated protein kinase kinase 1 inhibitor
Unknown
Approved
Neoplasms
COBIMETINIB
×
Maximum Phase:
4
First Approval:
2015
UNII:
ER29L26N1X
Molecule Type:
Small molecule
Molecular Formula:
C21H21F3IN3O2
Molecular Weight:
531.32
AlogP:
3.78
PSA:
64.6
HBD:
3.0
HBA:
#RotB:
4.0
Source:
ISAVUCONAZONIUM SULFATE
(2015)
Small molecule
Lanosterol 14-alpha demethylase inhibitor
INTRAVENOUS; ORAL
Approved
Aspergillosis; Mucormycosis
ISAVUCONAZONIUM SULFATE
×
Maximum Phase:
4
First Approval:
2015
UNII:
31Q44514JV
Molecule Type:
Small molecule
Molecular Formula:
C35H36F2N8O9S2
Molecular Weight:
814.85
AlogP:
4.58
PSA:
159.37
HBD:
2.0
HBA:
#RotB:
13.0
Source:
TIPIRACIL HYDROCHLORIDE
(2015)
Small molecule
Thymidine phosphorylase inhibitor
Unknown
Approved
Colorectal Neoplasms
TIPIRACIL HYDROCHLORIDE
×
Maximum Phase:
4
First Approval:
2015
UNII:
4H59KLQ0A4
Molecule Type:
Small molecule
Molecular Formula:
C9H12Cl2N4O2
Molecular Weight:
279.13
AlogP:
1.11
PSA:
93.33
HBD:
3.0
HBA:
#RotB:
2.0
Source:
COBIMETINIB FUMARATE
(2015)
Small molecule
Dual specificity mitogen-activated protein kinase kinase 1 inhibitor
ORAL
Approved
Melanoma
COBIMETINIB FUMARATE
×
Maximum Phase:
4
First Approval:
2015
UNII:
6EXI96H8SV
Molecule Type:
Small molecule
Molecular Formula:
C46H46F6I2N6O8
Molecular Weight:
1178.7
AlogP:
3.78
PSA:
64.6
HBD:
3.0
HBA:
#RotB:
4.0
Source:
EDOXABAN
(2015)
Small molecule
Unknown
Unknown
Approved
Thrombosis
EDOXABAN
×
Maximum Phase:
4
First Approval:
2015
UNII:
NDU3J18APO
Molecule Type:
Small molecule
Molecular Formula:
C24H30ClN7O4S
Molecular Weight:
548.07
AlogP:
1.29
PSA:
136.63
HBD:
3.0
HBA:
#RotB:
5.0
Source:
CARIPRAZINE
(2015)
Small molecule
Unknown
Unknown
Approved
Psychotic Disorders
CARIPRAZINE
×
Maximum Phase:
4
First Approval:
2015
UNII:
F6RJL8B278
Molecule Type:
Small molecule
Molecular Formula:
C21H32Cl2N4O
Molecular Weight:
427.42
AlogP:
4.34
PSA:
38.82
HBD:
1.0
HBA:
#RotB:
5.0
Source:
PANOBINOSTAT LACTATE
(2015)
Small molecule
Histone deacetylase inhibitor
ORAL
Approved
Multiple Myeloma
PANOBINOSTAT LACTATE
×
Maximum Phase:
4
First Approval:
2015
UNII:
HN0T99OO4V
Molecule Type:
Small molecule
Molecular Formula:
C24H29N3O5
Molecular Weight:
439.51
AlogP:
3.33
PSA:
77.15
HBD:
4.0
HBA:
#RotB:
7.0
Source:
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PSA