Compounds

Type:
Unknown

AlogP:
5.61

Polar Surface Area:
34.47

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.38

DETAILS

ALA4536533

Name:
2-(3-(4-Chlorophenyl)-9H-carbazol-9-yl)-N-(3-metho
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Mol. Formula:
C29H25ClN2O2

M.W.:
468.98

Type:
Unknown

AlogP:
6.78

Polar Surface Area:
34.47

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.27

DETAILS

ALA4535242

Name:
2-(3-(3-Chlorophenyl)-9H-carbazol-9-yl)-N-(3-metho
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Mol. Formula:
C29H25ClN2O2

M.W.:
468.98

Type:
Unknown

AlogP:
6.78

Polar Surface Area:
34.47

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.27

DETAILS

ALA4532562

Name:
N-Ethyl-N-(3-methoxybenzyl)-2-(3-(4-methoxyphenyl)
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Mol. Formula:
C31H30N2O3

M.W.:
478.59

Type:
Unknown

AlogP:
6.53

Polar Surface Area:
43.70

HBA:
4

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.25

DETAILS

ALA4560218

Name:
N-(3-Methoxybenzyl)-N-methyl-2-(3-phenyl-9H-carbaz
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Mol. Formula:
C29H26N2O2

M.W.:
434.54

9 activity values

Type:
Unknown

AlogP:
6.13

Polar Surface Area:
34.47

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.32

DETAILS

ALA4554031

Name:
N-Benzyl-2-(9H-carbazol-9-yl)acetamide

Mol. Formula:
C21H18N2O

M.W.:
314.39

Type:
Unknown

AlogP:
4.11

Polar Surface Area:
34.03

HBA:
2

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.60

DETAILS

ALA4551915

Name:
2-(9H-Carbazol-9-yl)-N-ethyl-N-(4-fluorobenzyl)ace
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Mol. Formula:
C23H21FN2O

M.W.:
360.43

Type:
Unknown

AlogP:
4.98

Polar Surface Area:
25.24

HBA:
2

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.49

DETAILS

ALA4571475

Name:
N-(4-Acetamidobenzyl)-2-(9H-carbazol-9-yl)-N-ethyl
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Mol. Formula:
C25H25N3O2

M.W.:
399.49

Type:
Unknown

AlogP:
4.80

Polar Surface Area:
54.34

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.51

DETAILS

ALA4527909

Name:
2-((5-Chlorothiophen-2-yl)ethynyl)-9-methyl-N-phen
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Mol. Formula:
C20H16ClN5S

M.W.:
393.90

8 activity values

6 unique targets

Type:
Unknown

AlogP:
4.13

Polar Surface Area:
55.63

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.53

DETAILS

ALA4518499

Name:
2-(3-Bromo-9H-carbazol-9-yl)-N-(3-methoxybenzyl)-N
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Mol. Formula:
C23H21BrN2O2

M.W.:
437.34

Type:
Unknown

AlogP:
5.22

Polar Surface Area:
34.47

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.43

DETAILS

ALA4744362

Name:
N-(3,5-Dimethylphenyl)-N-(4-(2-fluoroethoxy)benzyl
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Mol. Formula:
C19H22FNO2

M.W.:
315.39

Type:
Unknown

AlogP:
4.20

Polar Surface Area:
29.54

HBA:
2

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.80

DETAILS

ALA4743658

Name:
1-(4-Methoxybenzyl)-N-methyl-5-(methylsulfonamido)
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Mol. Formula:
C22H23N3O4S

M.W.:
425.51

Type:
Unknown

AlogP:
2.77

Polar Surface Area:
80.64

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.59

DETAILS

ALA4743573

Name:
N-benzyl-N-methyl-2-(11-oxo-10,11-dihydro-5H-diben
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Mol. Formula:
C23H21N3O2

M.W.:
371.44

Type:
Unknown

AlogP:
4.05

Polar Surface Area:
52.65

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.75

DETAILS

ALA4742171

Name:
N-benzyl-N-ethyl-2-(11-oxo-10,11-dihydro-5H-dibenz
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Mol. Formula:
C24H23N3O2

M.W.:
385.47

Type:
Unknown

AlogP:
4.44

Polar Surface Area:
52.65

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.71

DETAILS

ALA4742003

Name:
N-benzyl-2-(2-(4-methoxyphenyl)-5,7-dimethylpyrazo
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Mol. Formula:
C25H26N4O2

M.W.:
414.51

Type:
Unknown

AlogP:
4.22

Polar Surface Area:
59.73

HBA:
5

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.47

DETAILS

ALA4740988

Name:
N,N-Diethyl-1-(4-methoxybenzyl)-1H-benzo[d]imidazo
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Mol. Formula:
C20H23N3O2

M.W.:
337.42

Type:
Unknown

AlogP:
3.58

Polar Surface Area:
47.36

HBA:
4

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.69

DETAILS

ALA4762483

Name:
1-(4-Chlorobenzyl)-N-methyl-N-(prop-2-yn-1-yl)-1H-
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Mol. Formula:
C19H16ClN3O

M.W.:
337.81

Type:
Unknown

AlogP:
3.44

Polar Surface Area:
38.13

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.68

DETAILS

ALA4761316

Name:
N,N-dimethyl-2-(11-oxo-10,11-dihydro-5H-dibenzo[b,
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Mol. Formula:
C17H17N3O2

M.W.:
295.34

Type:
Unknown

AlogP:
2.48

Polar Surface Area:
52.65

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
Y

QED Weighted:
0.93

DETAILS

ALA4759879

Name:
2-((3,5-Dimethylphenyl)(4-(benzyloxy)benzyl)amino)
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Mol. Formula:
C28H34N2O2

M.W.:
430.59

Type:
Unknown

AlogP:
5.76

Polar Surface Area:
32.78

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.41

DETAILS

ALA4758934

Name:
N-benzyl-N-methyl-2-(1-methyl-4,10-dihydrobenzo[b]
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Mol. Formula:
C21H23N5O

M.W.:
361.45