Compounds

Type:
Unknown

AlogP:
4.36

Polar Surface Area:
39.72

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.55

DETAILS

ALA4558985

Name:
2-(benzhydryloxy)-3-hydroxy-N-(2-phenoxyethyl)prop
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Mol. Formula:
C26H29NO7

M.W.:
467.52

Type:
Unknown

AlogP:
3.82

Polar Surface Area:
50.72

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
11

Passes Ro3:
N

QED Weighted:
0.50

DETAILS

ALA4551941

Name:
Trans-2-(2-benzhydryl-1,3-dioxolan-4-yl)-N-(2-(2-m
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Mol. Formula:
C29H33NO8

M.W.:
523.58

Type:
Unknown

AlogP:
4.63

Polar Surface Area:
48.95

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
11

Passes Ro3:
N

QED Weighted:
0.45

DETAILS

ALA4570387

Name:
Trans-N-((2-benzhydryl-1,3-dioxolan-4-yl)methyl)-2
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Mol. Formula:
C28H31NO8

M.W.:
509.56

Type:
Unknown

AlogP:
4.24

Polar Surface Area:
48.95

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.50

DETAILS

ALA4526865

Name:
Cis-N-((2-benzhydryl-1,3-dioxolan-4-yl)methyl)-2-(
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Mol. Formula:
C28H31NO8

M.W.:
509.56

Type:
Unknown

AlogP:
4.24

Polar Surface Area:
48.95

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.50

DETAILS

ALA4580335

Name:
Trans-2-(2-benzhydryl-1,3-dioxolan-4-yl)-N-(2-phen
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Mol. Formula:
C28H31NO7

M.W.:
493.56

Type:
Unknown

AlogP:
4.62

Polar Surface Area:
39.72

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.50

DETAILS

ALA4579802

Name:
Cis-2-(2-benzhydryl-1,3-dioxolan-4-yl)-N-(2-(2-met
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Mol. Formula:
C29H33NO8

M.W.:
523.58

Type:
Unknown

AlogP:
4.63

Polar Surface Area:
48.95

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
11

Passes Ro3:
N

QED Weighted:
0.45

DETAILS

ALA4582160

Name:
N-((2,2-diphenyl-1,3-dioxan-4-yl)methyl)-2-phenoxy
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Mol. Formula:
C27H29NO7

M.W.:
479.53

Type:
Unknown

AlogP:
4.36

Polar Surface Area:
39.72

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.58

DETAILS

ALA4462768

Name:
Cis-N-((2-benzhydryl-1,3-dioxolan-4-yl)methyl)-2-p
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Mol. Formula:
C27H29NO7

M.W.:
479.53

Type:
Unknown

AlogP:
4.23

Polar Surface Area:
39.72

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.56

DETAILS

ALA4462600

Name:
2-(benzhydryloxy)-N-(2-phenoxyethyl)ethan-1-ammoni
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Mol. Formula:
C25H27NO6

M.W.:
437.49

Type:
Unknown

AlogP:
4.46

Polar Surface Area:
30.49

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.55

DETAILS

ALA4468507

Name:
2-(benzhydryloxy)-N-(2-(2-methoxyphenoxy)ethyl)eth
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Mol. Formula:
C26H29NO7

M.W.:
467.52

Type:
Unknown

AlogP:
4.47

Polar Surface Area:
39.72

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
11

Passes Ro3:
N

QED Weighted:
0.50

DETAILS

ALA4467585

Name:
N-((2,2-diphenyl-1,3-dioxan-4-yl)methyl)-2-(2-meth
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Mol. Formula:
C28H31NO8

M.W.:
509.56

Type:
Unknown

AlogP:
4.37

Polar Surface Area:
48.95

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA4473623

Name:
Cis-2-(2-benzhydryl-1,3-dioxolan-4-yl)-N-(2-phenox
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Mol. Formula:
C28H31NO7

M.W.:
493.56

Type:
Unknown

AlogP:
4.62

Polar Surface Area:
39.72

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.50

DETAILS

ALA4544457

Name:
N-((2,2-diphenyl-1,3-dioxan-5-yl)methyl)-2-phenoxy
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Mol. Formula:
C27H29NO7

M.W.:
479.53

Type:
Unknown

AlogP:
4.22

Polar Surface Area:
39.72

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.59

DETAILS

ALA4561614

Name:
1-((9H-carbazol-4-yl)oxy)-3-(4-(4-methoxyphenyl)pi
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Mol. Formula:
C26H29N3O3

M.W.:
431.54

4 unique targets

Type:
Unknown

AlogP:
3.89

Polar Surface Area:
60.96

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.46

DETAILS

ALA4458714

Name:
2-(2,2-Diphenyl-1,3-dioxolan-4-yl)-N-(2-(2-methoxy
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Mol. Formula:
C28H31NO8

M.W.:
509.56

Type:
Unknown

AlogP:
4.37

Polar Surface Area:
48.95

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.49

DETAILS

ALA4457585

Name:
Trans-N-((2-benzhydryl-1,3-dioxolan-4-yl)methyl)-2
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Mol. Formula:
C27H29NO7

M.W.:
479.53

Type:
Unknown

AlogP:
4.23

Polar Surface Area:
39.72

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.56

DETAILS

ALA4439658

Name:
2-(benzhydryloxy)-3-(2-(2-methoxyphenoxy)ethylamin
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Mol. Formula:
C27H31NO8

M.W.:
497.54