Compounds

ALA2289101

Name:
4-methyl-3-phenyl-1-(2-(thiophen-2-yl)propan-2-yl)
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Mol. Formula:
C18H19NOS

M.W.:
297.42

6 activity values

4 unique targets

Type:
Small molecule

AlogP:
4.30

Polar Surface Area:
20.31

HBA:
2

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.83

DETAILS

ALA2289100

Name:
4-methyl-3-phenyl-1-(2-(pyridin-2-yl)propan-2-yl)-
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Mol. Formula:
C19H20N2O

M.W.:
292.38

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
3.63

Polar Surface Area:
33.20

HBA:
2

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.87

DETAILS

ALA2289099

Name:
1-(2-(5-chlorothiophen-2-yl)propan-2-yl)-4-methyl-
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Mol. Formula:
C18H18ClNOS

M.W.:
331.87

6 activity values

4 unique targets

Type:
Small molecule

AlogP:
4.95

Polar Surface Area:
20.31

HBA:
2

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.78

DETAILS

ALA2289097

Name:
1-(2-(benzo[b]thiophen-2-yl)propan-2-yl)-4-methyl-
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Mol. Formula:
C22H21NOS

M.W.:
347.48

6 activity values

4 unique targets

Type:
Small molecule

AlogP:
5.45

Polar Surface Area:
20.31

HBA:
2

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.62

DETAILS

ALA2289096

Name:
1-(2-(benzofuran-2-yl)propan-2-yl)-4-methyl-3-phen
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Mol. Formula:
C22H21NO2

M.W.:
331.42

6 activity values

4 unique targets

Type:
Small molecule

AlogP:
4.98

Polar Surface Area:
33.45

HBA:
2

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.68

DETAILS

ALA2289094

Name:
1-(2-(benzo[d]oxazol-2-yl)propan-2-yl)-4-methyl-3-
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Mol. Formula:
C21H20N2O2

M.W.:
332.40

6 activity values

4 unique targets

Type:
Small molecule

AlogP:
4.38

Polar Surface Area:
46.34

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.71

DETAILS

ALA2289092

Name:
2-(2-(4-methyl-2-oxo-3-phenyl-2,5-dihydro-1H-pyrro
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Mol. Formula:
C21H20N2O2S

M.W.:
364.47

6 activity values

4 unique targets

Type:
Small molecule

AlogP:
4.09

Polar Surface Area:
47.25

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA2289091

Name:
4-methyl-1-(2-(1-methyl-1H-benzo[d]imidazol-2-yl)p
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Mol. Formula:
C22H23N3O

M.W.:
345.45

6 activity values

4 unique targets

Type:
Small molecule

AlogP:
4.12

Polar Surface Area:
38.13

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.72

DETAILS

ALA2289090

Name:
1-(2-(5-(4-chlorophenyl)thiazol-2-yl)propan-2-yl)-
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Mol. Formula:
C23H21ClN2OS

M.W.:
408.95

6 activity values

4 unique targets

Type:
Small molecule

AlogP:
6.01

Polar Surface Area:
33.20

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.53

DETAILS

ALA2289088

Name:
4-methyl-3-phenyl-1-(2-(2-phenylthiazol-4-yl)propa
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Mol. Formula:
C23H22N2OS

M.W.:
374.51

6 activity values

4 unique targets

Type:
Small molecule

AlogP:
5.36

Polar Surface Area:
33.20

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.62

DETAILS

ALA2289087

Name:
1-(2-(benzo[d]thiazol-2-yl)propan-2-yl)-3-phenyl-1
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Mol. Formula:
C20H18N2OS

M.W.:
334.44

6 activity values

4 unique targets

Type:
Small molecule

AlogP:
4.46

Polar Surface Area:
33.20

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.71

DETAILS

ALA2289086

Name:
1-(2-(benzo[d]thiazol-2-yl)propan-2-yl)-4-ethyl-3-
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Mol. Formula:
C22H22N2OS

M.W.:
362.50

6 activity values

4 unique targets

Type:
Small molecule

AlogP:
5.24

Polar Surface Area:
33.20

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.64

DETAILS

ALA2285708

Name:
1-(2-(benzo[d]thiazol-2-yl)propan-2-yl)-3-phenyl-4
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Mol. Formula:
C21H17F3N2OS

M.W.:
402.44

6 activity values

4 unique targets

Type:
Small molecule

AlogP:
5.39

Polar Surface Area:
33.20

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.59

DETAILS

ALA2289085

Name:
1-(2-(benzo[d]thiazol-2-yl)propan-2-yl)-3-(bipheny
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Mol. Formula:
C27H24N2OS

M.W.:
424.57

6 activity values

4 unique targets

Type:
Small molecule

AlogP:
6.51

Polar Surface Area:
33.20

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.37

DETAILS

ALA2289083

Name:
1-(2-(benzo[d]thiazol-2-yl)propan-2-yl)-4-methyl-3
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Mol. Formula:
C23H22N2OS

M.W.:
374.51

6 activity values

4 unique targets

Type:
Small molecule

AlogP:
5.40

Polar Surface Area:
33.20

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.61

DETAILS

ALA2289082

Name:
1-(2-(benzo[d]thiazol-2-yl)propan-2-yl)-3-(4-chlor
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Mol. Formula:
C21H19ClN2O2S

M.W.:
398.92

6 activity values

4 unique targets

Type:
Small molecule

AlogP:
5.38

Polar Surface Area:
42.43

HBA:
4

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.59

DETAILS

ALA2289079

Name:
1-(2-(benzo[d]thiazol-2-yl)propan-2-yl)-5-oxo-4-ph
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Mol. Formula:
C22H20N2O3S

M.W.:
392.48

6 activity values

4 unique targets

Type:
Small molecule

AlogP:
4.35

Polar Surface Area:
59.50

HBA:
5

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.62

DETAILS

ALA2289077

Name:
1-(2-(benzo[d]thiazol-2-yl)propan-2-yl)-3-(2-fluor
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Mol. Formula:
C21H19FN2OS

M.W.:
366.46

6 activity values

4 unique targets

Type:
Small molecule

AlogP:
4.99

Polar Surface Area:
33.20

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.65

DETAILS

ALA2289075

Name:
1-(2-(benzo[d]thiazol-2-yl)propan-2-yl)-3-(2-bromo
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Mol. Formula:
C21H19BrN2OS

M.W.:
427.37

6 activity values

4 unique targets

Type:
Small molecule

AlogP:
5.61

Polar Surface Area:
33.20

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.54

DETAILS

ALA2289072

Name:
1-(2-(benzo[d]thiazol-2-yl)propan-2-yl)-3-(4-chlor
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Mol. Formula:
C21H19ClN2OS

M.W.:
382.92

6 activity values

4 unique targets

Type:
Small molecule

AlogP:
5.50

Polar Surface Area:
33.20

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.60

DETAILS