Compounds

Type:
Small molecule

AlogP:
4.77

Polar Surface Area:
109.58

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.36

DETAILS

ALA2283576

Name:
5-((2'-carboxybiphenyl-4-yl)methyl)-3-isopropyl-1-propyl-1H-pyrazole-4-carbShow More⌵

Mol. Formula:
C24H26N2O4

M.W.:
406.48

Type:
Small molecule

AlogP:
5.07

Polar Surface Area:
92.42

HBA:
4

HBD:
2

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.54

DETAILS

ALA2283575

Name:
3-cyclopropyl-5-((2'-(N-phenylsulfamoyl)biphenyl-4-yl)methyl)-1-propyl-1H-pShow More⌵

Mol. Formula:
C29H30N4O3S

M.W.:
514.65

Type:
Small molecule

AlogP:
5.33

Polar Surface Area:
107.08

HBA:
5

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.30

DETAILS

ALA2283574

Name:
3-cyclopropyl-5-((2'-(N-phenylsulfamoyl)biphenyl-4-yl)methyl)-1-propyl-1H-pShow More⌵

Mol. Formula:
C29H29N3O4S

M.W.:
515.64

Type:
Small molecule

AlogP:
5.93

Polar Surface Area:
101.29

HBA:
5

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.27

DETAILS

ALA2283573

Name:
5-((2'-(N-(butoxycarbonyl)sulfamoyl)biphenyl-4-yl)methyl)-1-butyl-1H-pyrazoShow More⌵

Mol. Formula:
C26H31N3O6S

M.W.:
513.62

Type:
Small molecule

AlogP:
4.85

Polar Surface Area:
127.59

HBA:
7

HBD:
2

#RO5 Violations:
1

#Rotatable Bonds:
12

Passes Ro3:
N

QED Weighted:
0.33

DETAILS

ALA2283572

Name:
1-butyl-3-methyl-5-((2'-(N-phenylsulfamoyl)biphenyl-4-yl)methyl)-1H-pyrazolShow More⌵

Mol. Formula:
C28H29N3O4S

M.W.:
503.62

Type:
Small molecule

AlogP:
5.75

Polar Surface Area:
101.29

HBA:
5

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.29

DETAILS

ALA2283472

Name:
3-isopropyl-1-propyl-5-((2'-(trifluoromethylsulfonamido)biphenyl-4-yl)methyShow More⌵

Mol. Formula:
C24H26F3N3O4S

M.W.:
509.55

Type:
Small molecule

AlogP:
5.63

Polar Surface Area:
101.29

HBA:
5

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.39

DETAILS

ALA2281656

Name:
3-((2'-(1H-tetrazol-5-yl)biphenyl-4-yl)methyl)-2-butyl-4-oxo-N,N-diphenyl-3Show More⌵

Mol. Formula:
C37H32N8O2

M.W.:
620.72

Type:
Small molecule

AlogP:
7.24

Polar Surface Area:
114.59

HBA:
8

HBD:
1

#RO5 Violations:
2

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.18

DETAILS

ALA2281655

Name:
3-((2'-(1H-tetrazol-5-yl)biphenyl-4-yl)methyl)-2-butyl-N-methyl-4-oxo-N-pheShow More⌵

Mol. Formula:
C32H30N8O2

M.W.:
558.65

Type:
Small molecule

AlogP:
5.54

Polar Surface Area:
114.59

HBA:
8

HBD:
1

#RO5 Violations:
2

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.26

DETAILS

ALA2281654

Name:
3-((2'-(1H-tetrazol-5-yl)biphenyl-4-yl)methyl)-2-butyl-4-oxo-N-phenyl-3H-imShow More⌵

Mol. Formula:
C31H28N8O2

M.W.:
544.62

Type:
Small molecule

AlogP:
5.52

Polar Surface Area:
123.38

HBA:
8

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.26

DETAILS

ALA2281653

Name:
3-((2'-(1H-tetrazol-5-yl)biphenyl-4-yl)methyl)-N-tert-butyl-2-butyl-4-oxo-3Show More⌵

Mol. Formula:
C29H32N8O2

M.W.:
524.63

Type:
Small molecule

AlogP:
4.79

Polar Surface Area:
123.38

HBA:
8

HBD:
2

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.32

DETAILS

ALA2281652

Name:
1-(3-((2'-(1H-tetrazol-5-yl)biphenyl-4-yl)methyl)-2-ethyl-4-oxo-4,5-dihydroShow More⌵

Mol. Formula:
C32H35N9O3

M.W.:
593.69

Type:
Small molecule

AlogP:
3.96

Polar Surface Area:
134.90

HBA:
9

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.29

DETAILS

ALA2281651

Name:
1-(3-((2'-(1H-tetrazol-5-yl)biphenyl-4-yl)methyl)-2-butyl-4-oxo-4,5-dihydroShow More⌵

Mol. Formula:
C34H39N9O3

M.W.:
621.75

Type:
Small molecule

AlogP:
4.74

Polar Surface Area:
134.90

HBA:
9

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.24

DETAILS

ALA2281650

Name:
3-((2'-(1H-tetrazol-5-yl)biphenyl-4-yl)methyl)-N,N,2-triethyl-4-oxo-3H-imidShow More⌵

Mol. Formula:
C27H28N8O2

M.W.:
496.58

Type:
Small molecule

AlogP:
3.97

Polar Surface Area:
114.59

HBA:
8

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.36

DETAILS

ALA2281583

Name:
3-((2'-(1H-tetrazol-5-yl)biphenyl-4-yl)methyl)-2-butyl-N,N-diethyl-4-oxo-3HShow More⌵

Mol. Formula:
C29H32N8O2

M.W.:
524.63

Type:
Small molecule

AlogP:
4.75

Polar Surface Area:
114.59

HBA:
8

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.30

DETAILS

ALA2281582

Name:
3-((2'-(1H-tetrazol-5-yl)biphenyl-4-yl)methyl)-2-cyclopropyl-N,N-dimethyl-4Show More⌵

Mol. Formula:
C26H24N8O2

M.W.:
480.53

Type:
Small molecule

AlogP:
3.50

Polar Surface Area:
114.59

HBA:
8

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.41

DETAILS

ALA2281581

Name:
3-((2'-(1H-tetrazol-5-yl)biphenyl-4-yl)methyl)-2-ethyl-N,N-dimethyl-4-oxo-3Show More⌵

Mol. Formula:
C25H24N8O2

M.W.:
468.52

Type:
Small molecule

AlogP:
3.19

Polar Surface Area:
114.59

HBA:
8

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.42

DETAILS

ALA2281580

Name:
3-((2'-(1H-tetrazol-5-yl)biphenyl-4-yl)methyl)-N,N-dimethyl-4-oxo-2-propyl-Show More⌵

Mol. Formula:
C26H26N8O2

M.W.:
482.55

Type:
Small molecule

AlogP:
3.58

Polar Surface Area:
114.59

HBA:
8

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.40

DETAILS

ALA2281579

Name:
3-((2'-(1H-tetrazol-5-yl)biphenyl-4-yl)methyl)-2-butyl-N,N-dimethyl-4-oxo-3Show More⌵

Mol. Formula:
C27H28N8O2

M.W.:
496.58