Compounds

ALA540705

Name:
3-((2-(9H-xanthen-9-yl)ethyl)(methyl)amino)-1-(4-(benzo[c][1,2,5]oxadiazol-Show More⌵

Mol. Formula:
C29H31N5O3

M.W.:
497.60

8 activity values

8 unique targets

Type:
Small molecule

AlogP:
4.52

Polar Surface Area:
74.94

HBA:
7

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.37

DETAILS

ALA460542

Name:
3-((2-(9H-xanthen-9-yl)ethyl)(methyl)amino)-1-(4-(3,4-difluorophenyl)piperaShow More⌵

Mol. Formula:
C29H31F2N3O2

M.W.:
491.58

23 activity values

17 unique targets

Type:
Small molecule

AlogP:
5.26

Polar Surface Area:
36.02

HBA:
4

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.45

DETAILS

ALA491498

Name:
3-((2-(9H-fluoren-9-yl)ethyl)(methyl)amino)-1-(4-(benzo[d][1,3]dioxol-5-yl)Show More⌵

Mol. Formula:
C30H34ClN3O3

M.W.:
520.07

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
4.59

Polar Surface Area:
45.25

HBA:
5

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.49

DETAILS

ALA491497

Name:
3-((2-(9H-fluoren-9-yl)ethyl)(methyl)amino)-1-(4-(imidazo[1,2-b]pyridazin-6Show More⌵

Mol. Formula:
C29H33ClN6O

M.W.:
517.08

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
3.90

Polar Surface Area:
56.98

HBA:
6

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.40

DETAILS

ALA523814

Name:
3-((2-(9H-fluoren-9-yl)ethyl)(methyl)amino)-1-(4-(benzo[c][1,2,5]oxadiazol-Show More⌵

Mol. Formula:
C29H32ClN5O2

M.W.:
518.06

8 activity values

8 unique targets

Type:
Small molecule

AlogP:
4.40

Polar Surface Area:
65.71

HBA:
6

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.39

DETAILS

ALA522135

Name:
3-((2-(9H-fluoren-9-yl)ethyl)(methyl)amino)-1-(4-(pyridin-4-yl)piperazin-1-Show More⌵

Mol. Formula:
C28H33ClN4O

M.W.:
477.05

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
4.25

Polar Surface Area:
39.68

HBA:
4

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.55

DETAILS

ALA491145

Name:
6-(4-(3-((2-(9H-fluoren-9-yl)ethyl)(methyl)amino)propanoyl)piperazin-1-yl)-Show More⌵

Mol. Formula:
C28H34ClN5O2

M.W.:
508.07

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
2.95

Polar Surface Area:
61.68

HBA:
6

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.53

DETAILS

ALA491144

Name:
6-(4-(3-((2-(9H-fluoren-9-yl)ethyl)(methyl)amino)propanoyl)piperazin-1-yl)-Show More⌵

Mol. Formula:
C29H35ClN4O2

M.W.:
507.08

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
3.56

Polar Surface Area:
48.79

HBA:
5

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.53

DETAILS

ALA491143

Name:
3-((2-(9H-fluoren-9-yl)ethyl)(methyl)amino)-1-(4-(2,6-dimethylphenyl)piperaShow More⌵

Mol. Formula:
C31H38ClN3O

M.W.:
504.12

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
5.48

Polar Surface Area:
26.79

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.46

DETAILS

ALA491508

Name:
2-(4-(3-((2-(9H-fluoren-9-yl)ethyl)(methyl)amino)propanoyl)piperazin-1-yl)bShow More⌵

Mol. Formula:
C30H33ClN4O

M.W.:
501.07

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
4.73

Polar Surface Area:
50.58

HBA:
4

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.51

DETAILS

ALA491507

Name:
3-((2-(9H-fluoren-9-yl)ethyl)(methyl)amino)-1-(4-(4-fluorophenyl)piperazin-Show More⌵

Mol. Formula:
C29H33ClFN3O

M.W.:
494.05

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
5.00

Polar Surface Area:
26.79

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.50

DETAILS

ALA495264

Name:
3-((2-(9H-fluoren-9-yl)ethyl)(methyl)amino)-1-(4-(3-(trifluoromethyl)phenylShow More⌵

Mol. Formula:
C30H33ClF3N3O

M.W.:
544.06

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
5.88

Polar Surface Area:
26.79

HBA:
3

HBD:
---

#RO5 Violations:
2

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.40

DETAILS

ALA470500

Name:
3-((2-(9H-fluoren-9-yl)ethyl)(methyl)amino)-1-(4-(4-(trifluoromethyl)phenylShow More⌵

Mol. Formula:
C30H33ClF3N3O

M.W.:
544.06

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
5.88

Polar Surface Area:
26.79

HBA:
3

HBD:
---

#RO5 Violations:
2

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.40

DETAILS

ALA473763

Name:
3-((2-(9H-fluoren-9-yl)ethyl)(methyl)amino)-1-(4-(3,4-difluorophenyl)piperaShow More⌵

Mol. Formula:
C29H32ClF2N3O

M.W.:
512.04

23 activity values

17 unique targets

Type:
Small molecule

AlogP:
5.14

Polar Surface Area:
26.79

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.47

DETAILS

ALA473762

Name:
3-((2-(9H-fluoren-9-yl)ethyl)(methyl)amino)-1-(4-(2,4-difluorophenyl)piperaShow More⌵

Mol. Formula:
C29H32ClF2N3O

M.W.:
512.04

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
5.14

Polar Surface Area:
26.79

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.47

DETAILS

ALA472752

Name:
3-((2-(9H-fluoren-9-yl)ethyl)(methyl)amino)-1-(4-(3-fluorophenyl)piperazin-Show More⌵

Mol. Formula:
C29H33ClFN3O

M.W.:
494.05

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
5.00

Polar Surface Area:
26.79

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.50

DETAILS

ALA472751

Name:
3-((2-(9H-fluoren-9-yl)ethyl)(methyl)amino)-1-(4-(3,4-dichlorophenyl)piperaShow More⌵

Mol. Formula:
C29H32Cl3N3O

M.W.:
544.95

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
6.17

Polar Surface Area:
26.79

HBA:
3

HBD:
---

#RO5 Violations:
2

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.38

DETAILS

ALA472750

Name:
3-((2-(9H-fluoren-9-yl)ethyl)(methyl)amino)-1-(4-(2-chlorophenyl)piperazin-Show More⌵

Mol. Formula:
C29H33Cl2N3O

M.W.:
510.51

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
5.51

Polar Surface Area:
26.79

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.45

DETAILS

ALA474745

Name:
3-((2-(9H-fluoren-9-yl)ethyl)(methyl)amino)-1-(4-(3-chlorophenyl)piperazin-Show More⌵

Mol. Formula:
C29H33Cl2N3O

M.W.:
510.51

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
5.51

Polar Surface Area:
26.79

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.45

DETAILS

ALA515113

Name:
3-((2-(9H-fluoren-9-yl)ethyl)(methyl)amino)-1-(4-(4-chlorophenyl)piperazin-Show More⌵

Mol. Formula:
C29H33Cl2N3O

M.W.:
510.51

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
5.51

Polar Surface Area:
26.79

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.45

DETAILS