Compounds

Type:
Unknown

AlogP:
3.00

Polar Surface Area:
52.65

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.85

DETAILS

ALA5093394

Name:
(S)-1-(1-(1-morpholino-1-oxopropan-2-yl)piperidin-4-yl)-1H-benzo[d]imidazolShow More⌵

Mol. Formula:
C19H26N4O3

M.W.:
358.44

8 activity values

Type:
Unknown

AlogP:
1.21

Polar Surface Area:
70.57

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.90

DETAILS

ALA5092708

Name:
(S)-4-fluoro-N-(1-(2-oxo-1,2-dihydrospiro[benzo[d][1,3]oxazine-4,4'-piperidShow More⌵

Mol. Formula:
C22H24FN3O3

M.W.:
397.45

Type:
Unknown

AlogP:
3.50

Polar Surface Area:
70.67

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.83

DETAILS

ALA5092706

Name:
(S)-4-fluoro-N-(1-(2'-oxo-1',2'-dihydrospiro[piperidine-4,4'-pyrido[4,3-d][Show More⌵

Mol. Formula:
C21H23FN4O3

M.W.:
398.44

Type:
Unknown

AlogP:
2.89

Polar Surface Area:
83.56

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.83

DETAILS

ALA5092677

Name:
1-(1-((S)-1-((3R,5S)-3,5-dimethylpiperazin-1-yl)-1-oxopropan-2-yl)piperidinShow More⌵

Mol. Formula:
C21H31N5O2

M.W.:
385.51

8 activity values

Type:
Unknown

AlogP:
1.56

Polar Surface Area:
73.37

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.84

DETAILS

ALA5092637

Name:
(S)-4-fluoro-N-(1-(4-(2-oxobenzo[d]oxazol-3(2H)-yl)piperidin-1-yl)propan-2-Show More⌵

Mol. Formula:
C22H24FN3O3

M.W.:
397.45

Type:
Unknown

AlogP:
3.19

Polar Surface Area:
67.48

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.72

DETAILS

ALA5090919

Name:
(S)-4-fluoro-N-(1-(2'-oxo-2',3'-dihydro-1'H-spiro[piperidine-4,4'-quinolin]Show More⌵

Mol. Formula:
C23H26FN3O2

M.W.:
395.48

Type:
Unknown

AlogP:
3.32

Polar Surface Area:
61.44

HBA:
3

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.83

DETAILS

ALA5088048

Name:
1-(1-((S)-1-((S)-3-ethylpiperazin-1-yl)-1-oxopropan-2-yl)piperidin-4-yl)-1HShow More⌵

Mol. Formula:
C21H31N5O2

M.W.:
385.51

Type:
Unknown

AlogP:
1.57

Polar Surface Area:
73.37

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.84

DETAILS

ALA5087594

Name:
(S)-4-fluoro-N-(1-(4-(2-oxoimidazolidin-1-yl)piperidin-1-yl)propan-2-yl)benShow More⌵

Mol. Formula:
C18H25FN4O2

M.W.:
348.42

Type:
Unknown

AlogP:
1.43

Polar Surface Area:
64.68

HBA:
3

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.85

DETAILS

ALA5086717

Name:
1-(1-((S)-1-((S)-3-methylpiperazin-1-yl)-1-oxopropan-2-yl)piperidin-4-yl)-1Show More⌵

Mol. Formula:
C20H29N5O2

M.W.:
371.49

Type:
Unknown

AlogP:
1.18

Polar Surface Area:
73.37

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.85

DETAILS

ALA5086297

Name:
(S)-1-(1-(1-(3,3-difluoropyrrolidin-1-yl)-1-oxopropan-2-yl)piperidin-4-yl)-Show More⌵

Mol. Formula:
C19H24F2N4O2

M.W.:
378.42

Type:
Unknown

AlogP:
2.22

Polar Surface Area:
61.34

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.89

DETAILS

ALA5085809

Name:
1-(1-((S)-1-((3R,5R)-3,5-dimethylpiperazin-1-yl)-1-oxopropan-2-yl)piperidinShow More⌵

Mol. Formula:
C21H31N5O2

M.W.:
385.51

37 activity values

12 unique targets

Type:
Unknown

AlogP:
1.56

Polar Surface Area:
73.37

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.84

DETAILS

ALA5085765

Name:
(S)-N-(1-(4-(1H-indazol-3-yl)piperidin-1-yl)propan-2-yl)-4-fluorobenzamide

Mol. Formula:
C22H25FN4O

M.W.:
380.47

Type:
Unknown

AlogP:
3.70

Polar Surface Area:
61.02

HBA:
3

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.71

DETAILS

ALA5085284

Name:
4-fluoro-N-((S)-1-((R)-5-(3-fluorophenyl)-2-oxo-1-oxa-3,9-diazaspiro[5.5]unShow More⌵

Mol. Formula:
C24H27F2N3O3

M.W.:
443.49

Type:
Unknown

AlogP:
3.44

Polar Surface Area:
70.67

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.74

DETAILS

ALA5083676

Name:
(S)-4-fluoro-N-(1-(3'-methyl-2'-oxo-2',3'-dihydro-1'H-spiro[piperidine-4,4'Show More⌵

Mol. Formula:
C23H27FN4O2

M.W.:
410.49

7 activity values

Type:
Unknown

AlogP:
3.41

Polar Surface Area:
64.68

HBA:
3

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.81

DETAILS

ALA5083605

Name:
(S)-4-fluoro-N-(1-(7-fluoro-2-oxo-1,2-dihydrospiro[benzo[d][1,3]oxazine-4,4Show More⌵

Mol. Formula:
C22H23F2N3O3

M.W.:
415.44

Type:
Unknown

AlogP:
3.64

Polar Surface Area:
70.67

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.80

DETAILS

ALA5081973

Name:
(S)-1-(1-(1-(3,3-dimethylpiperazin-1-yl)-1-oxopropan-2-yl)piperidin-4-yl)-1Show More⌵

Mol. Formula:
C21H31N5O2

M.W.:
385.51

8 activity values

Type:
Unknown

AlogP:
1.57

Polar Surface Area:
73.37

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.84

DETAILS

ALA5080871

Name:
1-(1-((S)-1-((R)-3-methylpiperazin-1-yl)-1-oxopropan-2-yl)piperidin-4-yl)-1Show More⌵

Mol. Formula:
C20H29N5O2

M.W.:
371.49

7 activity values

3 unique targets

Type:
Unknown

AlogP:
1.18

Polar Surface Area:
73.37

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.85

DETAILS

ALA5080858

Name:
1-(1-((S)-1-((R)-2-methylpiperazin-1-yl)-1-oxopropan-2-yl)piperidin-4-yl)-1Show More⌵

Mol. Formula:
C20H29N5O2

M.W.:
371.49

5 activity values

3 unique targets

Type:
Unknown

AlogP:
1.18

Polar Surface Area:
73.37

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.85

DETAILS

ALA5080618

Name:
(S)-4-fluoro-N-(1-(2'-oxo-2',3'-dihydro-1'H-spiro[piperidine-4,4'-quinazoliShow More⌵

Mol. Formula:
C22H25FN4O2

M.W.:
396.47