Compounds

ALA4129851

Name:
2-(4-(Bis(5-chloro-1H-indol-3-yl)methyl)phenyl)-5-(2-nitrophenyl)-1,3,4-oxaShow More⌵

Mol. Formula:
C31H19Cl2N5O3

M.W.:
580.43

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
8.76

Polar Surface Area:
113.64

HBA:
5

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.15

DETAILS

ALA4129801

Name:
2-(4-(Bis(5-chloro-1H-indol-3-yl)methyl)phenyl)-5-(3-chlorophenyl)-1,3,4-oxShow More⌵

Mol. Formula:
C31H19Cl3N4O

M.W.:
569.88

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
9.51

Polar Surface Area:
70.50

HBA:
3

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.22

DETAILS

ALA4129729

Name:
4-(5-(4-(Bis(5-chloro-1H-indol-3-yl)methyl)phenyl)-1,3,4-oxadiazol-2-yl)benShow More⌵

Mol. Formula:
C31H20Cl2N4O3

M.W.:
567.43

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
8.26

Polar Surface Area:
110.96

HBA:
5

HBD:
4

#RO5 Violations:
2

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.17

DETAILS

ALA4129587

Name:
2-(5-(4-(Bis(5-chloro-1H-indol-3-yl)methyl)phenyl)-1,3,4-oxadiazol-2-yl)benShow More⌵

Mol. Formula:
C31H20Cl2N4O3

M.W.:
567.43

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
8.26

Polar Surface Area:
110.96

HBA:
5

HBD:
4

#RO5 Violations:
2

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.16

DETAILS

ALA4129552

Name:
2-(5-(4-(Bis(5-chloro-1H-indol-3-yl)methyl)phenyl)-1,3,4-oxadiazol-2-yl)-5-Show More⌵

Mol. Formula:
C32H22Cl2N4O3

M.W.:
581.46

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
8.57

Polar Surface Area:
99.96

HBA:
5

HBD:
3

#RO5 Violations:
2

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.18

DETAILS

ALA4129475

Name:
2-(4-(Bis(5-chloro-1H-indol-3-yl)methyl)phenyl)-5-(3-nitrophenyl)-1,3,4-oxaShow More⌵

Mol. Formula:
C31H19Cl2N5O3

M.W.:
580.43

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
8.76

Polar Surface Area:
113.64

HBA:
5

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.15

DETAILS

ALA4129469

Name:
5-(5-(4-(Bis(5-chloro-1H-indol-3-yl)methyl)phenyl)-1,3,4-oxadiazol-2-yl)-2-Show More⌵

Mol. Formula:
C32H22Cl2N4O3

M.W.:
581.46

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
8.57

Polar Surface Area:
99.96

HBA:
5

HBD:
3

#RO5 Violations:
2

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.18

DETAILS

ALA4129149

Name:
2-(4-(Bis(5-chloro-1H-indol-3-yl)methyl)phenyl)-5-(2-chlorophenyl)-1,3,4-oxShow More⌵

Mol. Formula:
C31H19Cl3N4O

M.W.:
569.88

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
9.51

Polar Surface Area:
70.50

HBA:
3

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.22

DETAILS

ALA4128771

Name:
3-(5-(4-(Bis(5-chloro-1H-indol-3-yl)methyl)phenyl)-1,3,4-oxadiazol-2-yl)pheShow More⌵

Mol. Formula:
C31H20Cl2N4O2

M.W.:
551.43

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
8.56

Polar Surface Area:
90.73

HBA:
4

HBD:
3

#RO5 Violations:
2

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.20

DETAILS

ALA4128440

Name:
2-(4-(Bis(5-chloro-1H-indol-3-yl)methyl)phenyl)-5-(4-chlorophenyl)-1,3,4-oxShow More⌵

Mol. Formula:
C31H19Cl3N4O

M.W.:
569.88

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
9.51

Polar Surface Area:
70.50

HBA:
3

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.22

DETAILS

ALA4128386

Name:
2-(4-(Bis(5-chloro-1H-indol-3-yl)methyl)phenyl)-5-(pyridin-3-yl)-1,3,4-oxadShow More⌵

Mol. Formula:
C30H19Cl2N5O

M.W.:
536.42

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
8.25

Polar Surface Area:
83.39

HBA:
4

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.23

DETAILS

ALA4128317

Name:
2-(4-(Bis(5-chloro-1H-indol-3-yl)methyl)phenyl)-5-(m-tolyl)-1,3,4-oxadiazolShow More⌵

Mol. Formula:
C32H22Cl2N4O

M.W.:
549.46

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
9.16

Polar Surface Area:
70.50

HBA:
3

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.22

DETAILS

ALA4128171

Name:
2-(4-(Bis(5-chloro-1H-indol-3-yl)methyl)phenyl)-5-(o-tolyl)-1,3,4-oxadiazolShow More⌵

Mol. Formula:
C32H22Cl2N4O

M.W.:
549.46

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
9.16

Polar Surface Area:
70.50

HBA:
3

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.22

DETAILS

ALA4128092

Name:
2-(5-(4-(Bis(5-chloro-1H-indol-3-yl)methyl)phenyl)-1,3,4-oxadiazol-2-yl)-4-Show More⌵

Mol. Formula:
C32H22Cl2N4O3

M.W.:
581.46

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
8.57

Polar Surface Area:
99.96

HBA:
5

HBD:
3

#RO5 Violations:
2

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.18

DETAILS

ALA4127521

Name:
2-(5-(4-(Bis(5-chloro-1H-indol-3-yl)methyl)phenyl)-1,3,4-oxadiazol-2-yl)pheShow More⌵

Mol. Formula:
C31H20Cl2N4O2

M.W.:
551.43

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
8.56

Polar Surface Area:
90.73

HBA:
4

HBD:
3

#RO5 Violations:
2

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.20

DETAILS

ALA4127377

Name:
4-(5-(4-(Bis(5-chloro-1H-indol-3-yl)methyl)phenyl)-1,3,4-oxadiazol-2-yl)pheShow More⌵

Mol. Formula:
C31H20Cl2N4O2

M.W.:
551.43

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
8.56

Polar Surface Area:
90.73

HBA:
4

HBD:
3

#RO5 Violations:
2

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.20

DETAILS

ALA4127084

Name:
2-(4-(Bis(5-chloro-1H-indol-3-yl)methyl)phenyl)-5-(2-fluorophenyl)-1,3,4-oxShow More⌵

Mol. Formula:
C31H19Cl2FN4O

M.W.:
553.42

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
8.99

Polar Surface Area:
70.50

HBA:
3

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.22

DETAILS

ALA4127013

Name:
2-(4-(Bis(5-chloro-1H-indol-3-yl)methyl)phenyl)-5-(pyridin-2-yl)-1,3,4-oxadShow More⌵

Mol. Formula:
C30H19Cl2N5O

M.W.:
536.42

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
8.25

Polar Surface Area:
83.39

HBA:
4

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.23

DETAILS

ALA4126935

Name:
2-(4-(Bis(5-chloro-1H-indol-3-yl)methyl)phenyl)-5-(p-tolyl)-1,3,4-oxadiazolShow More⌵

Mol. Formula:
C32H22Cl2N4O

M.W.:
549.46

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
9.16

Polar Surface Area:
70.50

HBA:
3

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.22

DETAILS

ALA4126296

Name:
3-(5-(4-(bis(5-chloro-1H-indol-3-yl)methyl)phenyl)-1,3,4-oxadiazol-2-yl)benShow More⌵

Mol. Formula:
C31H20Cl2N4O3

M.W.:
567.43

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
8.26

Polar Surface Area:
110.96

HBA:
5

HBD:
4

#RO5 Violations:
2

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.16

DETAILS