Compounds

ALA5272289

Name:
Methyl-5-(7-(1-methyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-3-yl)-3-(1-pheShow More⌵

Mol. Formula:
C25H22N4O3S

M.W.:
458.54

Type:
---

AlogP:
5.39

Polar Surface Area:
70.65

HBA:
8

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.32

DETAILS

ALA5272205

Name:
N-methyl-N-((3R,4R)-4-methyl-1-(5-methyl-2-((4-nitrobenzyl)thio)-[1,2,4]triShow More⌵

Mol. Formula:
C26H28N10O2S

M.W.:
544.65

Type:
---

AlogP:
4.26

Polar Surface Area:
134.27

HBA:
11

HBD:
1

#RO5 Violations:
2

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.18

DETAILS

ALA5272198

Name:
N-methyl-N-((3R,4R)-4-methyl-1-(5-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-Show More⌵

Mol. Formula:
C24H25N9

M.W.:
439.53

Type:
---

AlogP:
3.41

Polar Surface Area:
91.13

HBA:
8

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.46

DETAILS

ALA5271927

Name:
Dehydroabietyl 2-(4-((2,3-dioxoindolin-1-yl)methyl)-1H-1,2,3-triazol-1-yl)aShow More⌵

Mol. Formula:
C33H38N4O4

M.W.:
554.69

Type:
---

AlogP:
5.38

Polar Surface Area:
94.39

HBA:
7

HBD:
---

#RO5 Violations:
2

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.29

DETAILS

ALA5271827

Name:
Dehydroabietyl 2-(4-((p-tolyloxy)methyl)-1H-1,2,3-triazol-1-yl)acetate

Mol. Formula:
C32H41N3O3

M.W.:
515.70

Type:
---

AlogP:
6.54

Polar Surface Area:
66.24

HBA:
6

HBD:
---

#RO5 Violations:
2

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.32

DETAILS

ALA5271810

Name:
Methyl-5-(7-(1-(2-(piperidin-1-yl)ethyl)-1H-pyrazol-4-yl)imidazo[1,2-a]pyriShow More⌵

Mol. Formula:
C32H32F3N5O3S

M.W.:
623.70

Type:
---

AlogP:
7.36

Polar Surface Area:
73.89

HBA:
9

HBD:
---

#RO5 Violations:
2

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.16

DETAILS

ALA5270473

Name:
N-((3R,4R)-1-(2-((3-chloro-4-fluorobenzyl)thio)-5-methyl-[1,2,4]triazolo[1,Show More⌵

Mol. Formula:
C26H27ClFN9S

M.W.:
552.08

Type:
---

AlogP:
5.14

Polar Surface Area:
91.13

HBA:
9

HBD:
1

#RO5 Violations:
2

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.29

DETAILS

ALA5269563

Name:
Dehydroabietyl 2-(4-((4-phenylpiperazin-1-yl)methyl)-1H-1,2,3-triazol-1-yl)Show More⌵

Mol. Formula:
C35H47N5O2

M.W.:
569.79

Type:
---

AlogP:
5.98

Polar Surface Area:
63.49

HBA:
7

HBD:
---

#RO5 Violations:
2

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.31

DETAILS

ALA5269537

Name:
Dehydroabietyl 2-(4-(((2-oxo-2H-chromen-4-yl)oxy)methyl)-1H-1,2,3-triazol-1Show More⌵

Mol. Formula:
C34H39N3O5

M.W.:
569.70

Type:
---

AlogP:
6.34

Polar Surface Area:
96.45

HBA:
8

HBD:
---

#RO5 Violations:
2

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.18

DETAILS

ALA5269521

Name:
Methyl-3-(1-(3-fluorophenyl)ethoxy)-5-(7-(1-methyl-1H-pyrazol-4-yl)-imidazoShow More⌵

Mol. Formula:
C25H21FN4O3S

M.W.:
476.53

Type:
---

AlogP:
5.53

Polar Surface Area:
70.65

HBA:
8

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.30

DETAILS

ALA5267966

Name:
Dehydroabietyl 2-(4-((4-fluorophenoxy)methyl)-1H-1,2,3-triazol-1-yl)acetate

Mol. Formula:
C31H38FN3O3

M.W.:
519.66

Type:
---

AlogP:
6.37

Polar Surface Area:
66.24

HBA:
6

HBD:
---

#RO5 Violations:
2

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.32

DETAILS

ALA5282530

Name:
N-((3R,4R)-1-(2-((4-chlorobenzyl)thio)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimShow More⌵

Mol. Formula:
C26H28ClN9S

M.W.:
534.09

Type:
---

AlogP:
5.00

Polar Surface Area:
91.13

HBA:
9

HBD:
1

#RO5 Violations:
2

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.30

DETAILS

ALA5282282

Name:
5-(7-(1-(2-(dimethylamino)ethyl)-1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-ylShow More⌵

Mol. Formula:
C27H27FN6O2S

M.W.:
518.62

Type:
---

AlogP:
4.87

Polar Surface Area:
90.68

HBA:
8

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.30

DETAILS

ALA5282268

Name:
N-((3R,4R)-1-(2-((4-bromobenzyl)thio)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimiShow More⌵

Mol. Formula:
C26H28BrN9S

M.W.:
578.54

Type:
---

AlogP:
5.11

Polar Surface Area:
91.13

HBA:
9

HBD:
1

#RO5 Violations:
2

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.28

DETAILS

ALA5282129

Name:
Methyl-5-(7-(1-(2-(dimethylamino)ethyl)-1H-pyrazol-4-yl)imidazo[1,2-a]pyridShow More⌵

Mol. Formula:
C28H28FN5O3S

M.W.:
533.63

Type:
---

AlogP:
5.55

Polar Surface Area:
73.89

HBA:
9

HBD:
---

#RO5 Violations:
2

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.23

DETAILS

ALA5281883

Name:
5-(7-(1-(2-(pyridine-1-yl)ethyl)-1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-ylShow More⌵

Mol. Formula:
C30H29F3N6O2S

M.W.:
594.66

Type:
---

AlogP:
6.28

Polar Surface Area:
90.68

HBA:
8

HBD:
1

#RO5 Violations:
2

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.22

DETAILS

ALA5281788

Name:
Dehydroabietyl 2-(4-((1,3-dioxoisoindolin-2-yl)methyl)-1H-1,2,3-triazol-1-yShow More⌵

Mol. Formula:
C33H38N4O4

M.W.:
554.69

Type:
---

AlogP:
5.45

Polar Surface Area:
94.39

HBA:
7

HBD:
---

#RO5 Violations:
2

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.28

DETAILS

ALA5281643

Name:
N-((3R,4R)-1-(2-((4-fluorobenzyl)thio)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimShow More⌵

Mol. Formula:
C26H28FN9S

M.W.:
517.64

Type:
---

AlogP:
4.49

Polar Surface Area:
91.13

HBA:
9

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.33

DETAILS

ALA5280777

Name:
Methyl-5-(7-(1-(2-(dimethylamino)ethyl)-1H-pyrazol-4-yl)imidazo[1,2-a]pyridShow More⌵

Mol. Formula:
C29H28F3N5O3S

M.W.:
583.64

Type:
---

AlogP:
6.43

Polar Surface Area:
73.89

HBA:
9

HBD:
---

#RO5 Violations:
2

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.19

DETAILS

ALA5280768

Name:
N-((3R,4R)-1-(2-(((1H-benzo[d]imidazol-2-yl)methyl)thio)-5-methyl-[1,2,4]trShow More⌵

Mol. Formula:
C27H29N11S

M.W.:
539.67

Type:
---

AlogP:
4.22

Polar Surface Area:
119.81

HBA:
10

HBD:
2

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.30

DETAILS