Compounds

Type:
Small molecule

AlogP:
2.29

Polar Surface Area:
137.93

HBA:
7

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.33

DETAILS

ALA4218343

Name:
N-hydroxy-1-((4-((2-methylquinolin-4-yl)methoxy)phenyl)sulfonamido)cyclobutShow More⌵

Mol. Formula:
C22H23N3O5S

M.W.:
441.51

Type:
Small molecule

AlogP:
2.83

Polar Surface Area:
117.62

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.38

DETAILS

ALA4218226

Name:
2-(1-Acetyl-3-((4-((2-ethylquinolin-4-yl)methoxy)phenyl)sulfonamido)azetidiShow More⌵

Mol. Formula:
C25H28N4O6S

M.W.:
512.59

Type:
Small molecule

AlogP:
2.15

Polar Surface Area:
137.93

HBA:
7

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.30

DETAILS

ALA4217702

Name:
2-(1-acetyl-3-((4-(but-2-yn-1-yloxy)phenyl)sulfonamido)azetidin-3-yl)-N-hydShow More⌵

Mol. Formula:
C17H21N3O6S

M.W.:
395.44

Type:
Small molecule

AlogP:
-0.14

Polar Surface Area:
125.04

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.34

DETAILS

ALA4217309

Name:
2-(1-acetyl-3-((4-((2-methylquinolin-4-yl)methoxy)phenyl)sulfonamido)azetidShow More⌵

Mol. Formula:
C24H26N4O6S

M.W.:
498.56

9 activity values

5 unique targets

Type:
Small molecule

AlogP:
1.90

Polar Surface Area:
137.93

HBA:
7

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.32

DETAILS

ALA4217104

Name:
2-(1-butyl-3-((4-((2-methylquinolin-4-yl)methoxy)phenyl)sulfonamido)azetidiShow More⌵

Mol. Formula:
C26H32N4O5S

M.W.:
512.63

Type:
Small molecule

AlogP:
3.15

Polar Surface Area:
120.86

HBA:
7

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
11

Passes Ro3:
N

QED Weighted:
0.27

DETAILS

ALA4216577

Name:
N-hydroxy-2-(1-(3-methylbutanoyl)-3-((4-((2-methylquinolin-4-yl)methoxy)pheShow More⌵

Mol. Formula:
C27H32N4O6S

M.W.:
540.64

Type:
Small molecule

AlogP:
2.92

Polar Surface Area:
137.93

HBA:
7

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.27

DETAILS

ALA4215521

Name:
N-hydroxy-1-(3-methylbutanoyl)-3-((4-((2-methylquinolin-4-yl)methoxy)phenylShow More⌵

Mol. Formula:
C26H30N4O6S

M.W.:
526.62

Type:
Small molecule

AlogP:
2.53

Polar Surface Area:
137.93

HBA:
7

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.29

DETAILS

ALA4215415

Name:
N-hydroxy-1-isobutyryl-3-((N-isopropyl-4-((2-methylquinolin-4-yl)methoxy)phShow More⌵

Mol. Formula:
C28H34N4O6S

M.W.:
554.67

Type:
Small molecule

AlogP:
3.26

Polar Surface Area:
129.14

HBA:
7

HBD:
2

#RO5 Violations:
1

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.31

DETAILS

ALA4215407

Name:
N-hydroxy-1-isobutyryl-3-((N-methyl-4-((2-methylquinolin-4-yl)methoxy)phenyShow More⌵

Mol. Formula:
C26H30N4O6S

M.W.:
526.62

34 activity values

21 unique targets

Type:
Small molecule

AlogP:
2.49

Polar Surface Area:
129.14

HBA:
7

HBD:
2

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.34

DETAILS

ALA4215233

Name:
N-hydroxy-1-(4-((2-methylquinolin-4-yl)methoxy)phenylsulfonamido)cyclopropaShow More⌵

Mol. Formula:
C21H21N3O5S

M.W.:
427.48

Type:
Small molecule

AlogP:
2.44

Polar Surface Area:
117.62

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.39

DETAILS

ALA4214744

Name:
2-(1-acetyl-3-((3-methyl-4-((2-methylquinolin-4-yl)methoxy)phenyl)sulfonamiShow More⌵

Mol. Formula:
C25H28N4O6S

M.W.:
512.59

Type:
Small molecule

AlogP:
2.21

Polar Surface Area:
137.93

HBA:
7

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.31

DETAILS

ALA4214448

Name:
N-hydroxy-2-((4-((2-methylquinolin-4-yl)methoxy)phenyl)sulfonamido)acetamidShow More⌵

Mol. Formula:
C19H19N3O5S

M.W.:
401.44

Type:
Small molecule

AlogP:
1.91

Polar Surface Area:
117.62

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.41

DETAILS

ALA4213946

Name:
N-hydroxy-1-((4-((2-methylquinolin-4-yl)methoxy)phenyl)sulfonamido)cyclohexShow More⌵

Mol. Formula:
C24H27N3O5S

M.W.:
469.56

Type:
Small molecule

AlogP:
3.61

Polar Surface Area:
117.62

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.36

DETAILS

ALA4213292

Name:
2-(1-acetyl-3-((4-((8-fluoro-2-methylquinolin-4-yl)methoxy)phenyl)sulfonamiShow More⌵

Mol. Formula:
C24H25FN4O6S

M.W.:
516.55

Type:
Small molecule

AlogP:
2.04

Polar Surface Area:
137.93

HBA:
7

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.31

DETAILS

ALA4212683

Name:
N-hydroxy-2-(1-((4-((2-methylquinolin-4-yl)methoxy)phenyl)sulfonamido)cycloShow More⌵

Mol. Formula:
C23H25N3O5S

M.W.:
455.54

Type:
Small molecule

AlogP:
3.22

Polar Surface Area:
117.62

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.35

DETAILS

ALA4212130

Name:
N-hydroxy-2-(3-((4-((2-methylquinolin-4-yl)methoxy)phenyl)sulfonamido)-1-(3Show More⌵

Mol. Formula:
C25H27F3N4O5S

M.W.:
552.58

Type:
Small molecule

AlogP:
3.30

Polar Surface Area:
120.86

HBA:
7

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.26

DETAILS

ALA4211704

Name:
isopropyl 3-(2-(hydroxyamino)-2-oxoethyl)-3-((4-((2-methylquinolin-4-yl)metShow More⌵

Mol. Formula:
C26H30N4O7S

M.W.:
542.61

Type:
Small molecule

AlogP:
2.90

Polar Surface Area:
147.16

HBA:
8

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.28

DETAILS

ALA4211141

Name:
N-hydroxy-1-((4-((2-methylquinolin-4-yl)methoxy)phenyl)sulfonamido)cyclopenShow More⌵

Mol. Formula:
C23H25N3O5S

M.W.:
455.54