Compounds

ALA1092286

Name:
2-Amino-4-(2'-fluoro-4'-phenylthiobiphenyl-4-yl)-2
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Mol. Formula:
C23H25FNO5PS

M.W.:
477.49

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
4.38

Polar Surface Area:
113.01

HBA:
5

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.32

DETAILS

ALA1092285

Name:
2-Amino-4-(4'-benzylthio-3-chlorobiphenyl-4-yl)-2-
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Mol. Formula:
C25H29ClNO4PS

M.W.:
506.00

Type:
Small molecule

AlogP:
5.12

Polar Surface Area:
95.94

HBA:
6

HBD:
4

#RO5 Violations:
2

#Rotatable Bonds:
11

Passes Ro3:
N

QED Weighted:
0.21

DETAILS

ALA1092284

Name:
2-Amino-4-[2'-fluoro-4'-(4-methylphenoxy)biphenyl-
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Mol. Formula:
C24H28NO6P

M.W.:
457.46

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
4.19

Polar Surface Area:
122.24

HBA:
5

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.34

DETAILS

ALA1092272

Name:
2-Amino-4-(4'-benzyloxy-2'-fluorobiphenyl-4-yl)-2-
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Mol. Formula:
C24H27FNO6P

M.W.:
475.45

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
3.80

Polar Surface Area:
122.24

HBA:
5

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
11

Passes Ro3:
N

QED Weighted:
0.31

DETAILS

ALA1090223

Name:
2-Amino-4-(4'-benzyloxy-3-chlorobiphenyl-4-yl)-2-(
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Mol. Formula:
C24H27ClNO6P

M.W.:
491.91

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
4.32

Polar Surface Area:
122.24

HBA:
5

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
11

Passes Ro3:
N

QED Weighted:
0.29

DETAILS

ALA1093574

Name:
2-Amino-4-(3-chloro-4'-phenoxybiphenyl-4-yl)-2-(ph
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Mol. Formula:
C23H25ClNO6P

M.W.:
477.88

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
4.53

Polar Surface Area:
122.24

HBA:
5

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.32

DETAILS

ALA1093573

Name:
2-Amino-4-(4'-phenoxybiphenyl-4-yl)-2-(phosphorylo
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Mol. Formula:
C23H26NO6P

M.W.:
443.44

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
3.88

Polar Surface Area:
122.24

HBA:
5

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.35

DETAILS

ALA1089564

Name:
2-Amino-4-(4'-butoxy-3'-chlorobiphenyl-4-yl)-2-(ph
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Mol. Formula:
C21H29ClNO6P

M.W.:
457.89

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
3.92

Polar Surface Area:
122.24

HBA:
5

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
12

Passes Ro3:
N

QED Weighted:
0.28

DETAILS

ALA1091630

Name:
2-Amino-4-(4'-butoxy-3'-fluorobiphenyl-4-yl)-2-(ph
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Mol. Formula:
C21H29FNO6P

M.W.:
441.44

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
3.40

Polar Surface Area:
122.24

HBA:
5

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
12

Passes Ro3:
N

QED Weighted:
0.29

DETAILS

ALA1089558

Name:
2-amino-4-(4'-butoxy-2',5'-difluorobiphenyl-4-yl)-
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Mol. Formula:
C21H28F2NO6P

M.W.:
459.43

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
3.54

Polar Surface Area:
122.24

HBA:
5

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
12

Passes Ro3:
N

QED Weighted:
0.28

DETAILS

ALA1089557

Name:
2-Amino-4-(4'-butoxy-2'-fluorobiphenyl-4-yl)-2-(ph
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Mol. Formula:
C21H30F2NO6P

M.W.:
461.44

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
3.40

Polar Surface Area:
122.24

HBA:
5

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
12

Passes Ro3:
N

QED Weighted:
0.29

DETAILS

ALA1096211

Name:
2-amino-4-(4'-butoxybiphenyl-4-yl)-2-(hydroxymethy
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Mol. Formula:
C21H30NO6P

M.W.:
423.45

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
3.26

Polar Surface Area:
122.24

HBA:
5

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
12

Passes Ro3:
N

QED Weighted:
0.31

DETAILS

ALA1096210

Name:
2-amino-4-(3-chloro-4'-pentylbiphenyl-4-yl)-2-(hyd
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Mol. Formula:
C22H31ClNO5P

M.W.:
455.92

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
4.47

Polar Surface Area:
113.01

HBA:
4

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
12

Passes Ro3:
N

QED Weighted:
0.28

DETAILS

ALA1095889

Name:
2-amino-4-(2-fluoro-4-pentylphenyl)-2-(hydroxymeth
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Mol. Formula:
C16H27FNO5P

M.W.:
363.37

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
2.29

Polar Surface Area:
113.01

HBA:
4

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
11

Passes Ro3:
N

QED Weighted:
0.35

DETAILS

ALA1090828

Name:
(S)-2-amino-3-(4-(2-(biphenyl-4-yl)ethoxy)-2-(trif
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Mol. Formula:
C25H26F3N2O6P

M.W.:
538.46

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
4.76

Polar Surface Area:
131.11

HBA:
5

HBD:
4

#RO5 Violations:
1

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.27

DETAILS

ALA1093429

Name:
(S)-2-amino-3-(4-(2-(biphenyl-4-yl)ethoxy)-3-(trif
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Mol. Formula:
C25H26F3N2O6P

M.W.:
538.46

8 activity values

5 unique targets

Type:
Small molecule

AlogP:
4.76

Polar Surface Area:
131.11

HBA:
5

HBD:
4

#RO5 Violations:
1

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.27

DETAILS

ALA1093424

Name:
(S)-2-amino-3-(4-(2-(biphenyl-4-yl)ethoxy)-3-methy
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Mol. Formula:
C25H29N2O6P

M.W.:
484.49

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
4.05

Polar Surface Area:
131.11

HBA:
5

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.32

DETAILS

ALA1089127

Name:
(S)-2-amino-3-(4-(2-(biphenyl-4-yl)ethoxy)-3-bromo
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Mol. Formula:
C24H26BrN2O6P

M.W.:
549.36

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
4.50

Polar Surface Area:
131.11

HBA:
5

HBD:
4

#RO5 Violations:
1

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.27

DETAILS

ALA1088820

Name:
(S)-2-amino-3-(4-(2-(biphenyl-4-yl)ethoxy)-3-chlor
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Mol. Formula:
C24H26ClN2O6P

M.W.:
504.91

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
4.39

Polar Surface Area:
131.11

HBA:
5

HBD:
4

#RO5 Violations:
1

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.30

DETAILS

ALA1088819

Name:
(S)-2-amino-3-(4-(2-(biphenyl-4-yl)ethoxy)-3-cyano
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Mol. Formula:
C25H26N3O6P

M.W.:
495.47

4 activity values

3 unique targets

Type:
Small molecule

AlogP:
3.61

Polar Surface Area:
154.90

HBA:
6

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.31

DETAILS