Compounds

Type:
Unknown

AlogP:
4.09

Polar Surface Area:
61.44

HBA:
3

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.60

DETAILS

ALA4591820

Name:
N-((S)-1-((R)-4-(4-fluorophenyl)-1-oxo-2,8-diazaspiro[4.5]decan-8-yl)propanShow More⌵

Mol. Formula:
C26H28FN3O2

M.W.:
433.53

Type:
Unknown

AlogP:
2.68

Polar Surface Area:
61.44

HBA:
3

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.73

DETAILS

ALA4584012

Name:
(R)-N-(2-(4-(4-fluorophenyl)-1-oxo-2,8-diazaspiro[4.5]decan-8-yl)ethyl)-3-pShow More⌵

Mol. Formula:
C25H26FN3O2

M.W.:
419.50

Type:
Unknown

AlogP:
2.29

Polar Surface Area:
61.44

HBA:
3

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.75

DETAILS

ALA4581260

Name:
4-fluoro-N-((S)-1-((S)-4-(4-fluorophenyl)-1-oxo-2,8-diazaspiro[4.5]decan-8-Show More⌵

Mol. Formula:
C24H27F2N3O2

M.W.:
427.50

Type:
Unknown

AlogP:
3.08

Polar Surface Area:
61.44

HBA:
3

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.77

DETAILS

ALA4570440

Name:
N-((S)-1-((S)-4-(4-fluorophenyl)-1-oxo-2,8-diazaspiro[4.5]decan-8-yl)propanShow More⌵

Mol. Formula:
C27H29FN4O2

M.W.:
460.55

Type:
Unknown

AlogP:
3.49

Polar Surface Area:
74.33

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.61

DETAILS

ALA4514153

Name:
N-((S)-1-((S)-4-(4-fluorophenyl)-1-oxo-2,8-diazaspiro[4.5]decan-8-yl)propanShow More⌵

Mol. Formula:
C26H28FN3O2

M.W.:
433.53

Type:
Unknown

AlogP:
2.68

Polar Surface Area:
61.44

HBA:
3

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.73

DETAILS

ALA4453586

Name:
N-((S)-1-((S)-4-(4-fluorophenyl)-1-oxo-2,8-diazaspiro[4.5]decan-8-yl)propanShow More⌵

Mol. Formula:
C26H29FN4O2

M.W.:
448.54

5 activity values

Type:
Unknown

AlogP:
3.42

Polar Surface Area:
77.23

HBA:
3

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.56

DETAILS

ALA4448918

Name:
N-((S)-1-((R)-4-(4-fluorophenyl)-1-oxo-2,8-diazaspiro[4.5]decan-8-yl)propanShow More⌵

Mol. Formula:
C26H29FN4O2

M.W.:
448.54

Type:
Unknown

AlogP:
3.42

Polar Surface Area:
77.23

HBA:
3

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.56

DETAILS

ML299

Name:
(S)-4-bromo-N-(1-(1-(3-fluorophenyl)-4-oxo-1,3,8-triazaspiro[4.5]decan-8-ylShow More⌵

Mol. Formula:
C23H26BrFN4O2

M.W.:
489.39

11 activity values

5 unique targets

Type:
Unknown

AlogP:
3.14

Polar Surface Area:
64.68

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.68

DETAILS

ALA4436548

Name:
(R)-N-(2-(4-(4-fluorophenyl)-1-oxo-2,8-diazaspiro[4.5]decan-8-yl)ethyl)-1H-Show More⌵

Mol. Formula:
C25H27FN4O2

M.W.:
434.52

Type:
Unknown

AlogP:
3.03

Polar Surface Area:
77.23

HBA:
3

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.58

DETAILS

ALA3983405

Name:
(S)-4-fluoro-N-(2-(4-(4-fluorophenyl)-1-oxo-2,8-diazaspiro[4.5]decan-8-yl)eShow More⌵

Mol. Formula:
C23H25F2N3O2

M.W.:
413.47

8 activity values

Type:
Small molecule

AlogP:
3.53

Polar Surface Area:
64.93

HBA:
3

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.79

DETAILS

ALA3923136

Name:
(S)-N-(2-(4-(4-fluorophenyl)-1-oxo-2,8-diazaspiro[4.5]decan-8-yl)ethyl)quinShow More⌵

Mol. Formula:
C26H27FN4O2

M.W.:
446.53

5 activity values

Type:
Small molecule

AlogP:
3.94

Polar Surface Area:
77.82

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.62

DETAILS

ALA3561803

Name:
SID173128369

Mol. Formula:
C31H31ClF6N4O6

M.W.:
705.05

Type:
Small molecule

AlogP:
3.65

Polar Surface Area:
64.68

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.57

DETAILS

ALA3561781

Name:
SID173128375

Mol. Formula:
C30H31F6N5O6

M.W.:
671.60

Type:
Small molecule

AlogP:
2.39

Polar Surface Area:
77.57

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.61

DETAILS

ALA3561654

Name:
SID173128364

Mol. Formula:
C29H28F4N4O5

M.W.:
588.56

Type:
Small molecule

AlogP:
2.77

Polar Surface Area:
81.75

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.60

DETAILS

ALA3561646

Name:
SID173128357

Mol. Formula:
C31H32F6N4O6

M.W.:
670.61

Type:
Small molecule

AlogP:
2.99

Polar Surface Area:
64.68

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.62

DETAILS

ALA3561596

Name:
SID173128371

Mol. Formula:
C30H31F6N5O6

M.W.:
671.60

Type:
Small molecule

AlogP:
2.39

Polar Surface Area:
77.57

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.61

DETAILS

ALA3561583

Name:
SID173128405

Mol. Formula:
C28H29F6N5O7

M.W.:
661.56

4 activity values

Type:
Small molecule

AlogP:
1.98

Polar Surface Area:
90.71

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.62

DETAILS

ALA3561505

Name:
SID173128391

Mol. Formula:
C26H27Cl2F6N5O6

M.W.:
690.43

Type:
Small molecule

AlogP:
2.54

Polar Surface Area:
77.57

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.69

DETAILS

ALA3561066

Name:
SID173128370

Mol. Formula:
C31H31BrF6N4O6

M.W.:
749.50