Compounds

Type:
Small molecule

AlogP:
5.18

Polar Surface Area:
17.82

HBA:
2

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.63

DETAILS

ALA203952

Name:
2-(2,6-dichloro-4-(trifluoromethyl)phenyl)-6-fluoro-2,4,5,6-tetrahydrocycloShow More⌵

Mol. Formula:
C13H8Cl2F4N2

M.W.:
339.12

Type:
Small molecule

AlogP:
5.15

Polar Surface Area:
17.82

HBA:
2

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.66

DETAILS

ALA427379

Name:
2-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4,4,6,6-tetrafluoro-2,4,5,6-tetrShow More⌵

Mol. Formula:
C13H5Cl2F7N2

M.W.:
393.09

Type:
Small molecule

AlogP:
5.79

Polar Surface Area:
17.82

HBA:
2

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.56

DETAILS

ALA206464

Name:
2-(2,6-dichloro-4-(trifluoromethyl)phenyl)-6,6-difluoro-5,6-dihydrocyclopenShow More⌵

Mol. Formula:
C13H5Cl2F5N2O

M.W.:
371.09

Type:
Small molecule

AlogP:
4.88

Polar Surface Area:
34.89

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.67

DETAILS

ALA205262

Name:
2-(2,6-dichloro-4-(trifluoromethyl)phenyl)-5,6-dihydrocyclopenta[c]pyrazol-Show More⌵

Mol. Formula:
C13H7Cl2F3N2O

M.W.:
335.11

Type:
Small molecule

AlogP:
4.33

Polar Surface Area:
34.89

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.78

DETAILS

ALA206170

Name:
2-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-methyl-2,4,5,6-tetrahydrocycloShow More⌵

Mol. Formula:
C14H11Cl2F3N2

M.W.:
335.16

7 activity values

Type:
Small molecule

AlogP:
5.25

Polar Surface Area:
17.82

HBA:
2

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.70

DETAILS

ALA203278

Name:
2-(2,6-dichloro-4-(trifluoromethyl)phenyl)-5,5-difluoro-4-methyl-2,4,5,6-teShow More⌵

Mol. Formula:
C14H9Cl2F5N2O

M.W.:
387.13

Type:
Small molecule

AlogP:
4.60

Polar Surface Area:
38.05

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.73

DETAILS

ALA203226

Name:
2-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4,4,5,5-tetrafluoro-2,4,5,6-tetrShow More⌵

Mol. Formula:
C13H5Cl2F7N2

M.W.:
393.09

Type:
Small molecule

AlogP:
5.48

Polar Surface Area:
17.82

HBA:
2

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.59

DETAILS

ALA380879

Name:
2-(2,6-dichloro-4-(trifluoromethyl)phenyl)-5,5-difluoro-5,6-dihydrocyclopenShow More⌵

Mol. Formula:
C13H5Cl2F5N2O

M.W.:
371.09

Type:
Small molecule

AlogP:
4.57

Polar Surface Area:
34.89

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.69

DETAILS

ALA205569

Name:
2-(2,6-dichloro-4-(trifluoromethyl)phenyl)-5,5-difluoro-2,4,5,6-tetrahydrocShow More⌵

Mol. Formula:
C13H7Cl2F5N2

M.W.:
357.11

Type:
Small molecule

AlogP:
4.93

Polar Surface Area:
17.82

HBA:
2

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.66

DETAILS

ALA203684

Name:
2-(2,6-dichloro-4-(trifluoromethyl)phenyl)-5,6-difluoro-4-methyl-2,4,5,6-teShow More⌵

Mol. Formula:
C14H9Cl2F5N2O

M.W.:
387.13

Type:
Small molecule

AlogP:
4.77

Polar Surface Area:
38.05

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.72

DETAILS

ALA204682

Name:
2-(2,6-dichloro-4-(trifluoromethyl)phenyl)-5,6-difluoro-2,4,5,6-tetrahydrocShow More⌵

Mol. Formula:
C13H7Cl2F5N2

M.W.:
357.11

Type:
Small molecule

AlogP:
5.10

Polar Surface Area:
17.82

HBA:
2

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.65

DETAILS

ALA203580

Name:
2-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4,4-difluoro-2,4,5,6-tetrahydrocShow More⌵

Mol. Formula:
C13H7Cl2F5N2

M.W.:
357.11

Type:
Small molecule

AlogP:
5.24

Polar Surface Area:
17.82

HBA:
2

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.64

DETAILS

ALA206241

Name:
2-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-fluoro-2,4,5,6-tetrahydrocycloShow More⌵

Mol. Formula:
C13H8Cl2F4N2

M.W.:
339.12

Type:
Small molecule

AlogP:
5.15

Polar Surface Area:
17.82

HBA:
2

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.66

DETAILS

ALA206707

Name:
2-(2,6-dichloro-4-(trifluoromethyl)phenyl)-5-fluoro-4-methoxy-4-methyl-2,4,Show More⌵

Mol. Formula:
C15H12Cl2F4N2O

M.W.:
383.17