Compounds

ALA5287715

Name:
(S)-1-(4-chlorophenyl)-3-(1-(2-(2-hydroxyethyl)-2H
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Mol. Formula:
C19H21ClN6O3

M.W.:
416.87

Type:
---

AlogP:
2.43

Polar Surface Area:
114.19

HBA:
7

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA5286212

Name:
(S)-N-(1-amino-3-(4-chlorophenyl)-2-(3-(4-chloroph
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Mol. Formula:
C19H20Cl2N4O3

M.W.:
423.30

Type:
---

AlogP:
2.99

Polar Surface Area:
116.81

HBA:
3

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.40

DETAILS

ALA5285738

Name:
N-(4-bromophenyl)-2-(2,6-dioxo-5-phenyl-3,6-dihydr
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Mol. Formula:
C18H14BrN3O3

M.W.:
400.23

Type:
---

AlogP:
2.60

Polar Surface Area:
83.96

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.71

DETAILS

ALA5285150

Name:
2-[[(2S)-2-[(4-bromo-2-fluoro-phenyl)carbamoylamin
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Mol. Formula:
C15H19BrFN3O4

M.W.:
404.24

Type:
---

AlogP:
2.33

Polar Surface Area:
107.53

HBA:
3

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.56

DETAILS

ALA5284802

Name:
(R)-N-(4'-(3-(3-(3-fluoro-5-(trifluoromethyl)pyrid
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Mol. Formula:
C26H25F4N5O5S

M.W.:
595.58

Type:
---

AlogP:
4.60

Polar Surface Area:
129.73

HBA:
6

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.34

DETAILS

ALA5284349

Name:
(R)-N-(4'-(3-(3-(4-chlorophenyl)ureido)-2-oxopiper
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Mol. Formula:
C25H25ClN4O4S

M.W.:
513.02

Type:
---

AlogP:
4.70

Polar Surface Area:
107.61

HBA:
4

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.44

DETAILS

ALA5284145

Name:
N-(4-bromophenyl)-2-(5-(4-methoxybenzyl)-3,4-dimet
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Mol. Formula:
C22H22BrN3O3

M.W.:
456.34

Type:
---

AlogP:
3.86

Polar Surface Area:
73.22

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.61

DETAILS

ALA5284060

Name:
(R)-1-(4-chlorophenyl)-3-(1-(2'-(dimethylphosphory
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Mol. Formula:
C25H23ClF2N3O3P

M.W.:
517.90

Type:
---

AlogP:
5.46

Polar Surface Area:
78.51

HBA:
3

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.44

DETAILS

ALA5283999

Name:
(R)-1-(5-chloropyrazin-2-yl)-3-(1-(2'-(dimethylpho
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Mol. Formula:
C25H25ClF2N5O3P

M.W.:
547.93

Type:
---

AlogP:
4.89

Polar Surface Area:
104.29

HBA:
5

HBD:
2

#RO5 Violations:
1

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.44

DETAILS

ALA5283242

Name:
(S)-3-(4-cyanophenyl)-2-(3-(4-hydroxyphenyl)ureido
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Mol. Formula:
C27H26N4O3

M.W.:
454.53

Type:
---

AlogP:
3.84

Polar Surface Area:
114.25

HBA:
4

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.39

DETAILS

ALA5283221

Name:
1-[(3S,4R)-4-(2,6-difluoro-4-methoxy-phenyl)-2-oxo
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Mol. Formula:
C22H20F5N3O3

M.W.:
469.41

Type:
---

AlogP:
3.56

Polar Surface Area:
79.46

HBA:
3

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.59

DETAILS

ALA5283144

Name:
(R)-4'-(2-oxo-3-(3-(4-(trifluoromethyl)phenyl)urei
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Mol. Formula:
C26H23F3N4O3

M.W.:
496.49

Type:
---

AlogP:
4.79

Polar Surface Area:
104.53

HBA:
3

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.47

DETAILS

ALA5282261

Name:
1-(4-cyanophenyl)-3-((3S,4R)-4-(6-fluoro-2,3-dihyd
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Mol. Formula:
C20H17FN4O3

M.W.:
380.38

Type:
---

AlogP:
2.04

Polar Surface Area:
103.25

HBA:
4

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.76

DETAILS

ALA5282051

Name:
(R)-1-(4-chlorophenyl)-3-(1-hydroxy-3-(4-methoxyph
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Mol. Formula:
C17H19ClN2O3

M.W.:
334.80

Type:
---

AlogP:
3.07

Polar Surface Area:
70.59

HBA:
3

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.76

DETAILS

ALA5282050

Name:
(R)-3-(4-hydroxyphenyl)-2-(3-(4-methoxyphenyl)urei
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Mol. Formula:
C27H29N3O4

M.W.:
459.55

Type:
---

AlogP:
3.98

Polar Surface Area:
99.69

HBA:
4

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.39

DETAILS

ALA5281870

Name:
(S)-1-(4-chlorophenyl)-3-(1-(5-(2-hydroxyethyl)-1,
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Mol. Formula:
C20H21ClN4O4

M.W.:
416.87

Type:
---

AlogP:
3.37

Polar Surface Area:
109.51

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA5281612

Name:
1-[(3S,4R)-4-(4-chloro-2,6-difluoro-phenyl)-2-oxo-
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Mol. Formula:
C20H19ClF2N4O2

M.W.:
420.85

Type:
---

AlogP:
2.89

Polar Surface Area:
83.12

HBA:
3

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.71

DETAILS

ALA5280794

Name:
(S)-3-(4-hydroxyphenyl)-2-(3-(4-methoxyphenyl)urei
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Mol. Formula:
C27H29N3O4

M.W.:
459.55

Type:
---

AlogP:
3.98

Polar Surface Area:
99.69

HBA:
4

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.39

DETAILS

ALA5280720

Name:
(R)-N-((1-(4-(3-(3-(5-chloropyrazin-2-yl)ureido)-2
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Mol. Formula:
C22H27ClN6O4S

M.W.:
507.02

Type:
---

AlogP:
2.42

Polar Surface Area:
133.39

HBA:
6

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.53

DETAILS

ALA5279627

Name:
N-(4-bromophenyl)-2-(5-(3-methoxybenzyl)-3-methyl-
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Mol. Formula:
C27H24BrN3O3

M.W.:
518.41

Type:
---

AlogP:
5.22

Polar Surface Area:
73.22

HBA:
5

HBD:
1

#RO5 Violations:
2

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.36

DETAILS