Compounds

Type:
Unknown

AlogP:
3.48

Polar Surface Area:
84.50

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.74

DETAILS

ALA4740554

Name:
2-[6-(Methylamino)-5-[(3R)-3-phenoxy-1-piperidyl]p
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Mol. Formula:
C22H24N4O2

M.W.:
376.46

Type:
Unknown

AlogP:
3.94

Polar Surface Area:
70.51

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.70

DETAILS

ALA4762019

Name:
1-[3-Amino-6-(2-hydroxyphenyl)pyridazin-4-yl]piper
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Mol. Formula:
C15H16N4O2

M.W.:
284.32

Type:
Unknown

AlogP:
1.60

Polar Surface Area:
92.34

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.87

DETAILS

ALA4778417

Name:
(3S)-1-[3-Amino-6-(2-hydroxyphenyl)pyridazin-4-yl]
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Mol. Formula:
C15H18N4O2

M.W.:
286.33

Type:
Unknown

AlogP:
1.39

Polar Surface Area:
95.50

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.77

DETAILS

ALA4783838

Name:
(3R,4S)-1-[3-Amino-6-(2-hydroxyphenyl)pyridazine-4
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Mol. Formula:
C15H18N4O3

M.W.:
302.33

Type:
Unknown

AlogP:
0.36

Polar Surface Area:
115.73

HBA:
7

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.63

DETAILS

ALA4782909

Name:
(3R,4R)-1-[3-Amino-6-(2-hydroxyphenyl)pyridazine-4
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Mol. Formula:
C15H18N4O3

M.W.:
302.33

Type:
Unknown

AlogP:
0.36

Polar Surface Area:
115.73

HBA:
7

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.63

DETAILS

ALA4782464

Name:
2-(6-Amino-5-morpholino-pyridazin-3-yl)phenol

Mol. Formula:
C14H16N4O2

M.W.:
272.31

Type:
Unknown

AlogP:
1.27

Polar Surface Area:
84.50

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.86

DETAILS

ALA4790032

Name:
2-[6-(Methylamino)-5-[(3S)-3-phenoxy-1-piperidyl]p
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Mol. Formula:
C22H24N4O2

M.W.:
376.46

Type:
Unknown

AlogP:
3.94

Polar Surface Area:
70.51

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.70

DETAILS

ALA4746865

Name:
2-(6-Amino-5-piperazin-1-yl-pyridazin-3-yl)phenol

Mol. Formula:
C14H17N5O

M.W.:
271.32

14 activity values

4 unique targets

Type:
Unknown

AlogP:
0.84

Polar Surface Area:
87.30

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.75

DETAILS

ALA5207330

Name:
(R)-1-(4-(3-amino-6-(2-hydroxyphenyl)pyridazin-4-y
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Mol. Formula:
C17H21N5O2

M.W.:
327.39

31 activity values

12 unique targets

Type:
---

AlogP:
1.49

Polar Surface Area:
95.58

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.87

DETAILS

ALA5194650

Name:
4,6-diphenylpyridazin-3-amine

Mol. Formula:
C16H13N3

M.W.:
247.30

10 activity values

4 unique targets

Type:
---

AlogP:
3.39

Polar Surface Area:
51.80

HBA:
3

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.75

DETAILS

ALA5183240

Name:
4-phenyl-5H-pyridazino[4,3-b]indol-3-amine

Mol. Formula:
C16H12N4

M.W.:
260.30

Type:
---

AlogP:
3.36

Polar Surface Area:
67.59

HBA:
3

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.55

DETAILS

ALA5177096

Name:
2-(6-amino-5-phenylpyridazin-3-yl)phenol

Mol. Formula:
C16H13N3O

M.W.:
263.30

14 activity values

5 unique targets

Type:
---

AlogP:
3.10

Polar Surface Area:
72.03

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.74

DETAILS

ALA4292870

Name:
1-(2-chloropyridin-4-yl)-3-(pyridin-2-yl)urea

Mol. Formula:
C11H9ClN4O

M.W.:
248.67

Type:
Small molecule

AlogP:
2.77

Polar Surface Area:
66.91

HBA:
3

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.80

DETAILS

ALA4291666

Name:
1-(2-chloropyridin-4-yl)-3-(4-methyl-1H-imidazol-2
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Mol. Formula:
C10H10ClN5O

M.W.:
251.68

Type:
Small molecule

AlogP:
2.41

Polar Surface Area:
82.70

HBA:
3

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.72

DETAILS

ALA4290175

Name:
1-(2-chloropyridin-4-yl)-3-(2-(trifluoromethyl)pyr
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Mol. Formula:
C12H8ClF3N4O

M.W.:
316.67

Type:
Small molecule

AlogP:
3.79

Polar Surface Area:
66.91

HBA:
3

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.83

DETAILS

ALA4282784

Name:
1-(2-chloropyridin-4-yl)-3-(4-methylthiazol-2-yl)u
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Mol. Formula:
C10H9ClN4OS

M.W.:
268.73

Type:
Small molecule

AlogP:
3.14

Polar Surface Area:
66.91

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.82

DETAILS

ALA4281368

Name:
1-(2-chloropyridin-4-yl)-3-(2-methylpyridin-4-yl)u
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Mol. Formula:
C12H11ClN4O

M.W.:
262.70

Type:
Small molecule

AlogP:
3.08

Polar Surface Area:
66.91

HBA:
3

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.82

DETAILS

ALA4279505

Name:
1-(2-chloropyridin-4-yl)-3-(2-(difluoromethyl)pyri
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Mol. Formula:
C12H9ClF2N4O

M.W.:
298.68