Compounds

ALA3427498

Name:
(S)-2-(2-(5-(benzo[d][1,3]dioxol-5-yl)-2H-tetrazol-2-yl)-N-cyclohexylacetamShow More⌵

Mol. Formula:
C24H32N6O4

M.W.:
468.56

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
2.68

Polar Surface Area:
111.47

HBA:
8

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.66

DETAILS

ALA3427497

Name:
2-(5-(benzo[d][1,3]dioxol-5-yl)-2H-tetrazol-2-yl)-N-cyclohexyl-N-(2-(cyclopShow More⌵

Mol. Formula:
C23H30N6O4

M.W.:
454.53

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
2.29

Polar Surface Area:
111.47

HBA:
8

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.68

DETAILS

ALA3427496

Name:
2-(N-cyclohexyl-2-(5-(3,4-dimethoxyphenyl)-2H-tetrazol-2-yl)acetamido)-N-cyShow More⌵

Mol. Formula:
C27H40N6O4

M.W.:
512.66

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
3.60

Polar Surface Area:
111.47

HBA:
8

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA3427495

Name:
2-(N-cyclohexyl-2-(5-(3,4-dimethoxyphenyl)-2H-tetrazol-2-yl)acetamido)-N-cyShow More⌵

Mol. Formula:
C26H38N6O4

M.W.:
498.63

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
3.36

Polar Surface Area:
111.47

HBA:
8

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.56

DETAILS

ALA3427494

Name:
N-cyclopentyl-2-(2-(5-(3,4-dimethoxyphenyl)-2H-tetrazol-2-yl)-N-(1-methylpiShow More⌵

Mol. Formula:
C25H37N7O4

M.W.:
499.62

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
1.73

Polar Surface Area:
114.71

HBA:
9

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.55

DETAILS

ALA3427493

Name:
N-cyclopentyl-2-(2-(5-(3,4-dimethoxyphenyl)-2H-tetrazol-2-yl)-N-methylacetaShow More⌵

Mol. Formula:
C20H28N6O4

M.W.:
416.48

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
1.26

Polar Surface Area:
111.47

HBA:
8

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.69

DETAILS

ALA3427492

Name:
2-(2-(5-(benzo[d][1,3]dioxol-5-yl)-2H-tetrazol-2-yl)-N-(tetrahydro-2H-pyranShow More⌵

Mol. Formula:
C23H30N6O5

M.W.:
470.53

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
1.52

Polar Surface Area:
120.70

HBA:
9

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.65

DETAILS

ALA3427491

Name:
2-(N-(cyclohexylmethyl)-2-(5-(3,4-dimethoxyphenyl)-2H-tetrazol-2-yl)acetamiShow More⌵

Mol. Formula:
C26H38N6O4

M.W.:
498.63

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
3.21

Polar Surface Area:
111.47

HBA:
8

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.54

DETAILS

ALA3427490

Name:
N-cyclopentyl-2-(N-cyclopropyl-2-(5-(3,4-dimethoxyphenyl)-2H-tetrazol-2-yl)Show More⌵

Mol. Formula:
C22H30N6O4

M.W.:
442.52

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
1.80

Polar Surface Area:
111.47

HBA:
8

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.63

DETAILS

ALA3427489

Name:
2-(2-(5-(benzo[d][1,3]dioxol-5-yl)-2H-tetrazol-2-yl)-N-cyclohexylacetamido)Show More⌵

Mol. Formula:
C24H32N6O4

M.W.:
468.56

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
2.68

Polar Surface Area:
111.47

HBA:
8

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.66

DETAILS

ALA3427488

Name:
2-(N-cyclohexyl-2-(5-(4-fluorophenyl)-2H-tetrazol-2-yl)acetamido)-N-cyclopeShow More⌵

Mol. Formula:
C23H31FN6O2

M.W.:
442.54

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
3.09

Polar Surface Area:
93.01

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.71

DETAILS

ALA3427487

Name:
2-(N-cyclohexyl-2-(5-p-tolyl-2H-tetrazol-2-yl)acetamido)-N-cyclopentylpropaShow More⌵

Mol. Formula:
C24H34N6O2

M.W.:
438.58

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
3.26

Polar Surface Area:
93.01

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.72

DETAILS

ALA3427486

Name:
2-(N-cyclohexyl-2-(5-(2-fluorophenyl)-2H-tetrazol-2-yl)acetamido)-N-cyclopeShow More⌵

Mol. Formula:
C23H31FN6O2

M.W.:
442.54

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
3.09

Polar Surface Area:
93.01

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.71

DETAILS

ALA3427485

Name:
2-(N-cyclohexyl-2-(5-(3-fluorophenyl)-2H-tetrazol-2-yl)acetamido)-N-cyclopeShow More⌵

Mol. Formula:
C23H31FN6O2

M.W.:
442.54

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
3.09

Polar Surface Area:
93.01

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.71

DETAILS

ALA3427484

Name:
2-(N-cyclohexyl-2-(5-phenyl-2H-tetrazol-2-yl)acetamido)-N-cyclopentylpropanShow More⌵

Mol. Formula:
C23H32N6O2

M.W.:
424.55

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
2.95

Polar Surface Area:
93.01

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.74

DETAILS

ALA3427483

Name:
2-(N-cyclohexyl-2-(5-(2,2-difluorobenzo[d][1,3]dioxol-5-yl)-2H-tetrazol-2-yShow More⌵

Mol. Formula:
C24H30F2N6O4

M.W.:
504.54

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
3.27

Polar Surface Area:
111.47

HBA:
8

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.62

DETAILS

ALA3427482

Name:
2-(N-cyclohexyl-2-(5-(3,4-dichlorophenyl)-2H-tetrazol-2-yl)acetamido)-N-cycShow More⌵

Mol. Formula:
C23H30Cl2N6O2

M.W.:
493.44

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
4.26

Polar Surface Area:
93.01

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.62

DETAILS

ALA3427481

Name:
2-(2-(5-(4-chlorophenyl)-2H-tetrazol-2-yl)-N-cyclohexylacetamido)-N-cyclopeShow More⌵

Mol. Formula:
C23H31ClN6O2

M.W.:
458.99

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
3.60

Polar Surface Area:
93.01

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.68

DETAILS

ALA3427480

Name:
2-(2-(5-(2-chlorophenyl)-2H-tetrazol-2-yl)-N-cyclohexylacetamido)-N-cyclopeShow More⌵

Mol. Formula:
C23H31ClN6O2

M.W.:
458.99

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
3.60

Polar Surface Area:
93.01

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.68

DETAILS

ALA3427479

Name:
2-(N-cyclohexyl-2-(5-(2-methoxyphenyl)-2H-tetrazol-2-yl)acetamido)-N-cyclopShow More⌵

Mol. Formula:
C24H34N6O3

M.W.:
454.58

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
2.96

Polar Surface Area:
102.24

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.66

DETAILS