Compounds

Type:
Unknown

AlogP:
2.52

Polar Surface Area:
108.56

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.58

DETAILS

ALA4649534

Name:
(R)-3-(Cyclopentylmethyl)-4-((S)-6-(3-(2-fluoro-4-(trifluoromethyl)phenyl)-Show More⌵

Mol. Formula:
C25H28F4N4O4

M.W.:
524.52

Type:
Unknown

AlogP:
5.04

Polar Surface Area:
108.56

HBA:
6

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.30

DETAILS

ALA4646467

Name:
(R)-3-(Cyclopentylmethyl)-4-((S)-6-(3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl)Show More⌵

Mol. Formula:
C26H34N4O4

M.W.:
466.58

Type:
Unknown

AlogP:
4.44

Polar Surface Area:
108.56

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.44

DETAILS

ALA4645966

Name:
(R)-4-((S)-6-(3-(2-Chloro-4-(trifluoromethyl)phenyl)-1,2,4-oxadiazol-5-yl)-Show More⌵

Mol. Formula:
C25H28ClF3N4O4

M.W.:
540.97

Type:
Unknown

AlogP:
5.55

Polar Surface Area:
108.56

HBA:
6

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.35

DETAILS

ALA4645936

Name:
(S)-5-((R)-2-(Cyclopentylmethyl)-4-(hydroxyamino)-4-oxobutanoyl)-N-(thiazolShow More⌵

Mol. Formula:
C20H28N4O4S

M.W.:
420.54

Type:
Unknown

AlogP:
2.55

Polar Surface Area:
111.63

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.46

DETAILS

ALA4645201

Name:
(S)-5-((R)-2-(Cyclopentylmethyl)-4-(hydroxyamino)-4-oxobutanoyl)-N-(pyridazShow More⌵

Mol. Formula:
C21H29N5O4

M.W.:
415.49

Type:
Unknown

AlogP:
1.89

Polar Surface Area:
124.52

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.46

DETAILS

ALA4644600

Name:
(S)-5-((R)-2-(2-(Hydroxyamino)-2-oxoethyl)hexanoyl)-N-(5-methylthiazol-2-ylShow More⌵

Mol. Formula:
C19H28N4O4S

M.W.:
408.52

Type:
Unknown

AlogP:
2.47

Polar Surface Area:
111.63

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.45

DETAILS

ALA4643984

Name:
(R)-4-((S)-6-(3-(4-Butylphenyl)-1,2,4-oxadiazol-5-yl)-5-azaspiro-[2.4]heptaShow More⌵

Mol. Formula:
C28H38N4O4

M.W.:
494.64

Type:
Unknown

AlogP:
5.22

Polar Surface Area:
108.56

HBA:
6

HBD:
2

#RO5 Violations:
1

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.35

DETAILS

ALA4643967

Name:
(R)-4-((S)-6-(3-(4-Bromophenyl)-1,2,4-oxadiazol-5-yl)-5-azaspiro[2.4]heptanShow More⌵

Mol. Formula:
C24H29BrN4O4

M.W.:
517.42

Type:
Unknown

AlogP:
4.64

Polar Surface Area:
108.56

HBA:
6

HBD:
2

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.41

DETAILS

ALA4643686

Name:
(R)-3-(Cyclopentylmethyl)-N-hydroxy-4-oxo-4-((S)-6-(3-(pyrazin-2-yl)-1,2,4-Show More⌵

Mol. Formula:
C22H28N6O4

M.W.:
440.50

Type:
Unknown

AlogP:
2.67

Polar Surface Area:
134.34

HBA:
8

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.50

DETAILS

ALA4642360

Name:
(S)-1-((R)-2-(Cyclopentylmethyl)-4-(hydroxyamino)-4-oxobutanoyl)-N-(5-fluorShow More⌵

Mol. Formula:
C21H27FN4O4

M.W.:
418.47

Type:
Unknown

AlogP:
2.41

Polar Surface Area:
111.63

HBA:
5

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.36

DETAILS

ALA4641901

Name:
(S)-1-((R)-2-(Cyclopentylmethyl)-4-(hydroxyamino)-4-oxobutanoyl)-N-(5-methyShow More⌵

Mol. Formula:
C19H28N4O4S

M.W.:
408.52

Type:
Unknown

AlogP:
2.47

Polar Surface Area:
111.63

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.47

DETAILS

ALA4641571

Name:
(S)-5-((R)-2-(Cyclopentylmethyl)-4-(hydroxyamino)-4-oxobutanoyl)-N-(1-methyShow More⌵

Mol. Formula:
C21H31N5O4

M.W.:
417.51

Type:
Unknown

AlogP:
1.83

Polar Surface Area:
116.56

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.46

DETAILS

ALA4641416

Name:
(R)-3-(Cyclopentylmethyl)-4-((S)-6-(3-(5-fluoropyridin-2-yl)-1,2,4-oxadiazoShow More⌵

Mol. Formula:
C23H28FN5O4

M.W.:
457.51

Type:
Unknown

AlogP:
3.42

Polar Surface Area:
121.45

HBA:
7

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.48

DETAILS

ALA4641062

Name:
(R)-3-(Cyclopentylmethyl)-N-hydroxy-4-oxo-4-((S)-6-(3-phenyl-1,2,4-oxadiazoShow More⌵

Mol. Formula:
C24H30N4O4

M.W.:
438.53

11 activity values

9 unique targets

Type:
Unknown

AlogP:
3.88

Polar Surface Area:
108.56

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.50

DETAILS

ALA4640974

Name:
(S)-5-((R)-2-(Cyclopentylmethyl)-4-(hydroxyamino)-4-oxobutanoyl)-N-phenyl-5Show More⌵

Mol. Formula:
C23H31N3O4

M.W.:
413.52

Type:
Unknown

AlogP:
3.10

Polar Surface Area:
98.74

HBA:
4

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.47

DETAILS

ALA4640884

Name:
(R)-3-(Cyclopentylmethyl)-N-hydroxy-4-oxo-4-((S)-6-(3-(p-tolyl)-1,2,4-oxadiShow More⌵

Mol. Formula:
C25H32N4O4

M.W.:
452.56

Type:
Unknown

AlogP:
4.19

Polar Surface Area:
108.56

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.48

DETAILS

ALA4639327

Name:
(S)-N-(5-Fluoropyridin-2-yl)-5-((R)-2-(2-(hydroxyamino)-2-oxoethyl)hexanoylShow More⌵

Mol. Formula:
C20H27FN4O4

M.W.:
406.46

Type:
Unknown

AlogP:
2.24

Polar Surface Area:
111.63

HBA:
5

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.45

DETAILS

ALA4638180

Name:
(S)-5-((R)-2-(Cyclopentylmethyl)-4-(hydroxyamino)-4-oxobutanoyl)-N-(pyrimidShow More⌵

Mol. Formula:
C21H29N5O4

M.W.:
415.49