Compounds

Type:
---

AlogP:
4.55

Polar Surface Area:
87.66

HBA:
4

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.47

DETAILS

ALA5207590

Name:
(3R,4R,5S)-4-Acetamido-5-(((2-fluoro-5-methyl-[1,1'-biphenyl]-4-yl)methyl)aShow More⌵

Mol. Formula:
C28H35FN2O4

M.W.:
482.60

Type:
---

AlogP:
4.75

Polar Surface Area:
87.66

HBA:
4

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.45

DETAILS

ALA5207195

Name:
(3R,4R,5S)-4-Acetamido-5-(((3'-chloro-[1,1'-biphenyl]-4-yl)methyl)amino)-3-Show More⌵

Mol. Formula:
C27H33ClN2O4

M.W.:
485.02

Type:
---

AlogP:
4.96

Polar Surface Area:
87.66

HBA:
4

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.44

DETAILS

ALA5207060

Name:
(3R,4R,5S)-4-Acetamido-5-((benzofuran-5-ylmethyl)amino)-3-(pentan-3-yloxy)cShow More⌵

Mol. Formula:
C23H30N2O5

M.W.:
414.50

Type:
---

AlogP:
3.38

Polar Surface Area:
100.80

HBA:
5

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.58

DETAILS

ALA5207047

Name:
(3R,4R,5S)-4-Acetamido-5-((naphthalen-1-ylmethyl)amino)-3-(pentan-3-yloxy)cShow More⌵

Mol. Formula:
C25H32N2O4

M.W.:
424.54

Type:
---

AlogP:
3.79

Polar Surface Area:
87.66

HBA:
4

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.57

DETAILS

ALA5205952

Name:
(3R,4R,5S)-4-Acetamido-5-(((4'-(methoxycarbonyl)-[1,1'-biphenyl]-4-yl)methyShow More⌵

Mol. Formula:
C29H36N2O6

M.W.:
508.62

Type:
---

AlogP:
4.09

Polar Surface Area:
113.96

HBA:
6

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
11

Passes Ro3:
N

QED Weighted:
0.39

DETAILS

ALA5201314

Name:
(3R,4R,5S)-4-Acetamido-5-((2-chloro-4-(thiophen-2-yl)benzyl)amino)-3-(pentaShow More⌵

Mol. Formula:
C25H31ClN2O4S

M.W.:
491.05

21 activity values

Type:
---

AlogP:
5.02

Polar Surface Area:
87.66

HBA:
5

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.43

DETAILS

ALA5201108

Name:
(3R,4R,5S)-4-Acetamido-5-(((2,6-dimethyl-[1,1'-biphenyl]-4-yl)methyl)amino)Show More⌵

Mol. Formula:
C29H38N2O4

M.W.:
478.63

Type:
---

AlogP:
4.92

Polar Surface Area:
87.66

HBA:
4

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.45

DETAILS

ALA5200599

Name:
(3R,4R,5S)-4-Acetamido-5-((2-methyl-4-(thiophen-2-yl)benzyl)amino)-3-(pentaShow More⌵

Mol. Formula:
C26H34N2O4S

M.W.:
470.64

21 activity values

Type:
---

AlogP:
4.67

Polar Surface Area:
87.66

HBA:
5

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.47

DETAILS

ALA5200099

Name:
(3R,4R,5S)-4-Acetamido-5-(((3-fluoro-[1,1'-biphenyl]-4-yl)methyl)amino)-3-(Show More⌵

Mol. Formula:
C27H33FN2O4

M.W.:
468.57

Type:
---

AlogP:
4.44

Polar Surface Area:
87.66

HBA:
4

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.48

DETAILS

ALA5199555

Name:
(3R,4R,5S)-4-Acetamido-5-(((4'-chloro-[1,1'-biphenyl]-4-yl)methyl)amino)-3-Show More⌵

Mol. Formula:
C27H33ClN2O4

M.W.:
485.02

Type:
---

AlogP:
4.96

Polar Surface Area:
87.66

HBA:
4

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.44

DETAILS

ALA5199263

Name:
(3R,4R,5S)-4-Acetamido-5-((2,6-fluorine-4-(thiophen-2-yl)benzyl)amino)-3-(pShow More⌵

Mol. Formula:
C25H30F2N2O4S

M.W.:
492.59

6 activity values

3 unique targets

Type:
---

AlogP:
4.64

Polar Surface Area:
87.66

HBA:
5

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.45

DETAILS

ALA5198401

Name:
(3R,4R,5S)-4-Acetamido-5-(((3-methyl-[1,1'-biphenyl]-4-yl)methyl)amino)-3-(Show More⌵

Mol. Formula:
C28H36N2O4

M.W.:
464.61

Type:
---

AlogP:
4.61

Polar Surface Area:
87.66

HBA:
4

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.48

DETAILS

ALA5198125

Name:
(3R,4R,5S)-4-Acetamido-5-(((2'-methoxy-[1,1'-biphenyl]-4-yl)methyl)amino)-3Show More⌵

Mol. Formula:
C28H36N2O5

M.W.:
480.61

Type:
---

AlogP:
4.31

Polar Surface Area:
96.89

HBA:
5

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
11

Passes Ro3:
N

QED Weighted:
0.44

DETAILS

ALA5197852

Name:
(3R,4R,5S)-5-(((1H-Indol-6-yl)methyl)amino)-4-acetamido-3-(pentan-3-yloxy)cShow More⌵

Mol. Formula:
C23H31N3O4

M.W.:
413.52

Type:
---

AlogP:
3.12

Polar Surface Area:
103.45

HBA:
4

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.51

DETAILS

ALA5197508

Name:
(3R,4R,5S)-4-Acetamido-5-(((4'-fluoro-[1,1'-biphenyl]-4-yl)methyl)amino)-3-Show More⌵

Mol. Formula:
C27H33FN2O4

M.W.:
468.57

Type:
---

AlogP:
4.44

Polar Surface Area:
87.66

HBA:
4

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.48

DETAILS

ALA5197351

Name:
(3R,4R,5S)-4-Acetamido-5-((2-chloro-4-(thiophen-3-yl)benzyl)amino)-3-(pentaShow More⌵

Mol. Formula:
C25H31ClN2O4S

M.W.:
491.05

21 activity values

Type:
---

AlogP:
5.02

Polar Surface Area:
87.66

HBA:
5

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.43

DETAILS

ALA5196665

Name:
(3R,4R,5S)-4-Acetamido-5-((2-methoxy-4-(thiophen-3-yl)benzyl)amino)-3-(pentShow More⌵

Mol. Formula:
C26H34N2O5S

M.W.:
486.63

56 activity values