Compounds

ALA5267650

Name:
4-(3-chloro-4-methoxy-anilino)-7-(3,4-dimethylphenyl)-5H-pyrrolo[2,3-d]pyriShow More⌵

Mol. Formula:
C21H19ClN4O2

M.W.:
394.86

Type:
---

AlogP:
4.72

Polar Surface Area:
67.35

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.69

DETAILS

ALA5267224

Name:
2-((5-(2-chlorophenyl)-2H-tetrazol-2-yl)methyl)-6,7-dihydro-1H-cyclopenta[4Show More⌵

Mol. Formula:
C17H13ClN6OS

M.W.:
384.85

Type:
---

AlogP:
2.83

Polar Surface Area:
89.35

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.59

DETAILS

ALA5267071

Name:
(2R)-2-((3-Cyano-2-(2'-(dimethylamino)biphenyl-4-yl)-1,7-naphthyridin-4-yl)Show More⌵

Mol. Formula:
C27H26N6O

M.W.:
450.55

Type:
---

AlogP:
4.58

Polar Surface Area:
107.93

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.43

DETAILS

ALA5267048

Name:
N-(3-chloro-4-methoxyphenyl)-1-(4-methoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidiShow More⌵

Mol. Formula:
C19H16ClN5O2

M.W.:
381.82

Type:
---

AlogP:
4.23

Polar Surface Area:
74.09

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.56

DETAILS

ALA5266303

Name:
(2R)-2-((3-Cyano-2-(3'-fluorobiphenyl-4-yl)-1,7-naphthyridin-4-yl)amino)butShow More⌵

Mol. Formula:
C25H20FN5O

M.W.:
425.47

Type:
---

AlogP:
4.65

Polar Surface Area:
104.69

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.47

DETAILS

ALA5266252

Name:
2-((3-Cyano-2-(2'-ethoxybiphenyl-4-yl)-1,7-naphthyridin-4-yl)-amino)-2-cydoShow More⌵

Mol. Formula:
C28H25N5O2

M.W.:
463.54

Type:
---

AlogP:
4.91

Polar Surface Area:
113.92

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.38

DETAILS

ALA5266064

Name:
4-Amino-2-(2'-ethoxybiphenyl-4-yl)-1,7-naphthyridine-3-carbonitrile

Mol. Formula:
C23H18N4O

M.W.:
366.42

Type:
---

AlogP:
4.82

Polar Surface Area:
84.82

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.56

DETAILS

ALA5265871

Name:
N-(3-chloro-4-methoxy-phenyl)-1-[5-(trifluoromethyl)-2-pyridyl]pyrazolo[3,4Show More⌵

Mol. Formula:
C18H12ClF3N6O

M.W.:
420.78

Type:
---

AlogP:
4.63

Polar Surface Area:
77.75

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA5265849

Name:
(2R)-2-((3-Cyano-2-(3'-methylbiphenyl-4-yl)-1,7-naphthyridin-4-yl)amino)butShow More⌵

Mol. Formula:
C26H23N5O

M.W.:
421.50

Type:
---

AlogP:
4.82

Polar Surface Area:
104.69

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.46

DETAILS

ALA5282625

Name:
(2R)-2-((3-Cyano-2-(2'-(propan-2-yl)biphenyl-4-yl)-1,7-naphthyridin-4-yl)amShow More⌵

Mol. Formula:
C28H27N5O

M.W.:
449.56

Type:
---

AlogP:
5.63

Polar Surface Area:
104.69

HBA:
5

HBD:
2

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.38

DETAILS

ALA5282610

Name:
N2-(2-(4-Bromophenyl)-3-cyano-1,7-naphthyridin-4-yl)-2-methylalaninamid

Mol. Formula:
C20H17BrN4O

M.W.:
409.29

Type:
---

AlogP:
4.08

Polar Surface Area:
92.66

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.70

DETAILS

ALA5282526

Name:
(2R)-2-((3-Cyano-2-(3'-methoxybiphenyl-4-yl)-1,7-naphthyridin-4-yl)amino)buShow More⌵

Mol. Formula:
C26H23N5O2

M.W.:
437.50

Type:
---

AlogP:
4.52

Polar Surface Area:
113.92

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.44

DETAILS

ALA5282498

Name:
(S)-8-(4-(methylthio)phenyl)-6-oxo-3-(o-tolyl)-2,3,4,6,7,8-hexahydropyrido[Show More⌵

Mol. Formula:
C22H21N3OS2

M.W.:
407.56

Type:
---

AlogP:
4.94

Polar Surface Area:
47.34

HBA:
5

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.67

DETAILS

ALA5282490

Name:
N-(3-chloro-4-methoxy-phenyl)-1-(6-methyl-3-pyridyl)pyrazolo[3,4-d]pyrimidiShow More⌵

Mol. Formula:
C18H15ClN6O

M.W.:
366.81

Type:
---

AlogP:
3.92

Polar Surface Area:
77.75

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.59

DETAILS

ALA5282226

Name:
(2R)-2-((3-Cyano-2-(2'-fluorobiphenyl-4-yl)-1,7-naphthyridin-4-yl)amino)butShow More⌵

Mol. Formula:
C25H20FN5O

M.W.:
425.47

Type:
---

AlogP:
4.65

Polar Surface Area:
104.69

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.47

DETAILS

ALA5281907

Name:
4-amino-3-(5-(thiophen-2-yl)-2H-tetrazol-2-yl)-6,7-dihydro-1H-cyclopenta[4,Show More⌵

Mol. Formula:
C15H12N6OS2

M.W.:
356.44

Type:
---

AlogP:
2.36

Polar Surface Area:
102.48

HBA:
8

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.57

DETAILS

ALA5281763

Name:
(2R)-2((3-Cyano-2-(4-(3-methylpyridin-2-yl)phenyl)-1,7-naphthyridin-4-yl)amShow More⌵

Mol. Formula:
C25H22N6O

M.W.:
422.49

Type:
---

AlogP:
4.21

Polar Surface Area:
117.58

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.48

DETAILS

ALA5281676

Name:
(S)-(3-(furan-2-yl)-1H-pyrazol-5-yl)(3-(5-(trifluoromethyl)-1H-benzo[d][1,2Show More⌵

Mol. Formula:
C20H17F3N6O2

M.W.:
430.39

Type:
---

AlogP:
3.91

Polar Surface Area:
92.84

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.53

DETAILS

ALA5281421

Name:
N-(3-chloro-4-methoxyphenyl)-1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidinShow More⌵

Mol. Formula:
C18H13Cl2N5O

M.W.:
386.24

Type:
---

AlogP:
4.87

Polar Surface Area:
64.86

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.54

DETAILS

ALA5281250

Name:
N-(4-((7-(3,4-dimethylphenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)phenyl)Show More⌵

Mol. Formula:
C22H21N5O

M.W.:
371.44

Type:
---

AlogP:
4.74

Polar Surface Area:
71.84

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.54

DETAILS