Compounds

Type:
Unknown

AlogP:
4.24

Polar Surface Area:
87.13

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.64

DETAILS

ALA4872989

Name:
1-((2'-(1H-tetrazol-5-yl)biphenyl-4-yl)methyl)-2-b
Show More⌵

Mol. Formula:
C25H30N6O

M.W.:
430.56

6 activity values

5 unique targets

Type:
Unknown

AlogP:
4.88

Polar Surface Area:
87.13

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.55

DETAILS

ALA4859498

Name:
3-((2'-(1H-tetrazol-5-yl)biphenyl-4-yl)methyl)-2-b
Show More⌵

Mol. Formula:
C23H28N6O

M.W.:
404.52

5 activity values

Type:
Unknown

AlogP:
3.76

Polar Surface Area:
86.80

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.63

DETAILS

ALA4856425

Name:
1-((2'-(1H-tetrazol-5-yl)biphenyl-4-yl)methyl)-2-b
Show More⌵

Mol. Formula:
C28H28N6O

M.W.:
464.57

5 activity values

Type:
Unknown

AlogP:
5.38

Polar Surface Area:
87.13

HBA:
5

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.38

DETAILS

ALA4868159

Name:
(3S,7aS)-2-((2'-(1H-tetrazol-5-yl)biphenyl-4-yl)me
Show More⌵

Mol. Formula:
C24H28N6O

M.W.:
416.53

4 activity values

Type:
Unknown

AlogP:
3.86

Polar Surface Area:
78.01

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.63

DETAILS

ALA4757022

Name:
4'-((N-(4-Cyanophenyl)pentanamido)methyl)-[1,1'-bi
Show More⌵

Mol. Formula:
C26H24N2O3

M.W.:
412.49

Type:
Unknown

AlogP:
5.65

Polar Surface Area:
81.40

HBA:
3

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA4777189

Name:
4'-((N-Isopropylpentanamido)methyl)-[1,1'-biphenyl
Show More⌵

Mol. Formula:
C22H27NO3

M.W.:
353.46

Type:
Unknown

AlogP:
4.98

Polar Surface Area:
57.61

HBA:
2

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.73

DETAILS

ALA4755616

Name:
4'-((N-(3,4-Difluorophenyl)pentanamido)methyl)-[1,
Show More⌵

Mol. Formula:
C25H23F2NO3

M.W.:
423.46

Type:
Unknown

AlogP:
6.05

Polar Surface Area:
57.61

HBA:
2

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.48

DETAILS

ALA4755611

Name:
4'-((2-Cyclopropyl-N-phenylacetamido)methyl)-[1,1'
Show More⌵

Mol. Formula:
C25H23NO3

M.W.:
385.46

Type:
Unknown

AlogP:
5.39

Polar Surface Area:
57.61

HBA:
2

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.59

DETAILS

ALA4754354

Name:
N-((2'-Cyano-[1,1'-biphenyl]-4-yl)methyl)-N-phenyl
Show More⌵

Mol. Formula:
C25H24N2O

M.W.:
368.48

2 activity values

Type:
Unknown

AlogP:
5.95

Polar Surface Area:
44.10

HBA:
2

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA4754213

Name:
4'-((N-(p-Tolyl)pentanamido)methyl)-[1,1'-biphenyl
Show More⌵

Mol. Formula:
C26H27NO3

M.W.:
401.51

4 activity values

Type:
Unknown

AlogP:
6.08

Polar Surface Area:
57.61

HBA:
2

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.50

DETAILS

ALA4753841

Name:
4'-((N-Phenylbenzamido)methyl)-[1,1'-biphenyl]-2-c
Show More⌵

Mol. Formula:
C27H21NO3

M.W.:
407.47

Type:
Unknown

AlogP:
5.90

Polar Surface Area:
57.61

HBA:
2

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.43

DETAILS

ALA4753057

Name:
4'-((N-Phenylbutyramido)methyl)-[1,1'-biphenyl]-2-
Show More⌵

Mol. Formula:
C24H23NO3

M.W.:
373.45

Type:
Unknown

AlogP:
5.39

Polar Surface Area:
57.61

HBA:
2

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.60

DETAILS

ALA4752602

Name:
4'-((N-(4-Chlorophenyl)pentanamido)methyl)-[1,1'-b
Show More⌵

Mol. Formula:
C25H24ClNO3

M.W.:
421.92

Type:
Unknown

AlogP:
6.43

Polar Surface Area:
57.61

HBA:
2

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.46

DETAILS

ALA4751424

Name:
4'-((N-Methylpentanamido)methyl)-[1,1'-biphenyl]-2
Show More⌵

Mol. Formula:
C20H23NO3

M.W.:
325.41

Type:
Unknown

AlogP:
4.20

Polar Surface Area:
57.61

HBA:
2

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.83

DETAILS

ALA4750707

Name:
4'-((N-(4-Methoxyphenyl)pentanamido)methyl)-[1,1'-
Show More⌵

Mol. Formula:
C26H27NO4

M.W.:
417.51

Type:
Unknown

AlogP:
5.78

Polar Surface Area:
66.84

HBA:
3

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.48

DETAILS

ALA4794649

Name:
4'-((N-Cyclohexylpentanamido)methyl)-[1,1'-bipheny
Show More⌵

Mol. Formula:
C25H31NO3

M.W.:
393.53

Type:
Unknown

AlogP:
5.90

Polar Surface Area:
57.61

HBA:
2

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.61

DETAILS

ALA4794074

Name:
4'-((N-Phenylpentanamido)methyl)-[1,1'-biphenyl]-2
Show More⌵

Mol. Formula:
C25H26N2O2

M.W.:
386.50

4 activity values

Type:
Unknown

AlogP:
5.18

Polar Surface Area:
63.40

HBA:
2

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.58

DETAILS

ALA4792472

Name:
N-(4-(4-(Hydroxymethyl)pyridin-3-yl)benzyl)-N-phen
Show More⌵

Mol. Formula:
C25H27NO2

M.W.:
373.50

Type:
Unknown

AlogP:
5.57

Polar Surface Area:
40.54

HBA:
2

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.56

DETAILS

ALA4792217

Name:
4'-((N-(4-(Trifluoromethyl)phenyl)pentanamido)meth
Show More⌵

Mol. Formula:
C26H24F3NO3

M.W.:
455.48

2 activity values