Compounds

1 unique targets

Type:
Unknown

AlogP:
1.29

Polar Surface Area:
92.70

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.25

DETAILS

ALA4217313

Name:
N,N-dimethylpyrazolo[1,5-a]quinoxalin-4-amine

Mol. Formula:
C12H12N4

M.W.:
212.26

Type:
Small molecule

AlogP:
1.95

Polar Surface Area:
33.43

HBA:
4

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.62

DETAILS

ALA4216993

Name:
3-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyrazin-8-amine

Mol. Formula:
C14H14N4O2

M.W.:
270.29

Type:
Small molecule

AlogP:
2.00

Polar Surface Area:
74.67

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.79

DETAILS

ALA4215834

Name:
1,3-dibromo-N-methylimidazo[1,5-a]quinoxalin-4-amine

Mol. Formula:
C11H8Br2N4

M.W.:
356.02

Type:
Small molecule

AlogP:
3.45

Polar Surface Area:
42.22

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.73

DETAILS

ALA4215422

Name:
N,3-dimethylimidazo[1,2-a]pyrazin-8-amine

Mol. Formula:
C8H10N4

M.W.:
162.20

Type:
Small molecule

AlogP:
1.08

Polar Surface Area:
42.22

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.68

DETAILS

ALA4215227

Name:
3-bromo-N,7-dimethylpyrazolo[1,5-a]quinoxalin-4-amine

Mol. Formula:
C12H11BrN4

M.W.:
291.15

Type:
Small molecule

AlogP:
3.00

Polar Surface Area:
42.22

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.75

DETAILS

ALA4213700

Name:
4-(8-aminoimidazo[1,2-a]pyrazin-3-yl)benzene-1,2-diol

Mol. Formula:
C12H10N4O2

M.W.:
242.24

Type:
Small molecule

AlogP:
1.39

Polar Surface Area:
96.67

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.56

DETAILS

ALA4213228

Name:
4-(8-(methylamino)imidazo[1,2-a]pyrazin-3-yl)benzene-1,2-diol

Mol. Formula:
C13H12N4O2

M.W.:
256.26

Type:
Small molecule

AlogP:
1.85

Polar Surface Area:
82.68

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.61

DETAILS

ALA4212881

Name:
N,N,8-trimethylpyrazolo[1,5-a]quinoxalin-4-amine

Mol. Formula:
C13H14N4

M.W.:
226.28

Type:
Small molecule

AlogP:
2.26

Polar Surface Area:
33.43

HBA:
4

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.64

DETAILS

ALA4212355

Name:
N-methylpyrazolo[1,5-a]quinoxalin-4-amine

Mol. Formula:
C11H10N4

M.W.:
198.23

Type:
Small molecule

AlogP:
1.92

Polar Surface Area:
42.22

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.65

DETAILS

ALA4211938

Name:
3-(3,4-dimethoxyphenyl)-N-methylimidazo[1,2-a]pyrazin-8-amine

Mol. Formula:
C15H16N4O2

M.W.:
284.32

Type:
Small molecule

AlogP:
2.46

Polar Surface Area:
60.68

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.80

DETAILS

ALA4210816

Name:
3-bromo-N-methylpyrazolo[1,5-a]quinoxalin-4-amine

Mol. Formula:
C11H9BrN4

M.W.:
277.12

Type:
Small molecule

AlogP:
2.69

Polar Surface Area:
42.22

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.74

DETAILS

ALA4208499

Name:
3-bromo-N-methylimidazo[1,5-a]quinoxalin-4-amine

Mol. Formula:
C11H9BrN4

M.W.:
277.12

Type:
Small molecule

AlogP:
2.69

Polar Surface Area:
42.22

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.74

DETAILS

ALA4207981

Name:
N,8-dimethylpyrazolo[1,5-a]quinoxalin-4-amine

Mol. Formula:
C12H12N4

M.W.:
212.26

Type:
Small molecule

AlogP:
2.23

Polar Surface Area:
42.22

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.67

DETAILS

ALA4207550

Name:
N,N,7-trimethylpyrazolo[1,5-a]quinoxalin-4-amine

Mol. Formula:
C13H14N4

M.W.:
226.28

Type:
Small molecule

AlogP:
2.26

Polar Surface Area:
33.43

HBA:
4

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.64

DETAILS

ALA4205930

Name:
3-bromo-N,8-dimethylpyrazolo[1,5-a]quinoxalin-4-amine

Mol. Formula:
C12H11BrN4

M.W.:
291.15

Type:
Small molecule

AlogP:
3.00

Polar Surface Area:
42.22

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.75

DETAILS

ALA4202686

Name:
N,7-dimethylpyrazolo[1,5-a]quinoxalin-4-amine

Mol. Formula:
C12H12N4

M.W.:
212.26

Type:
Small molecule

AlogP:
2.23

Polar Surface Area:
42.22

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.67

DETAILS

ALA4104971

Name:
(S)-2-Amino-4-(3-hydroxypyrrolidin-1-yl)-7H-pyrrolo[2,3-d]-pyrimidine-5-carShow More⌵

Mol. Formula:
C11H12N6O

M.W.:
244.26

Type:
Small molecule

AlogP:
-0.02

Polar Surface Area:
114.85

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.65

DETAILS

ALA4104970

Name:
2-Amino-4-(4-hydroxyphenyl)-7H-pyrrolo[2,3-d]pyrimdine-5-carbonitrile

Mol. Formula:
C13H9N5O

M.W.:
251.25