Compounds

ALA1088538

Name:
Butyl 2-methylimidazo[1,2-a]pyrrolo[3,2-c]pyridine
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Mol. Formula:
C15H17N3O2

M.W.:
271.32

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
3.08

Polar Surface Area:
59.39

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.59

DETAILS

ALA1088537

Name:
Methyl 2-methylimidazo[1,2-a]pyrrolo[3,2-c]pyridin
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Mol. Formula:
C12H11N3O2

M.W.:
229.24

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
1.91

Polar Surface Area:
59.39

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.65

DETAILS

ALA1088536

Name:
methyl 2,7-dimethylimidazo[1,2-a]pyrrolo[3,2-c]pyr
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Mol. Formula:
C13H13N3O2

M.W.:
243.27

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
1.92

Polar Surface Area:
48.53

HBA:
5

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.61

DETAILS

ALA1088535

Name:
Ethyl 2,7-dimethylimidazo[1,2-a]pyrrolo[3,2-c]pyri
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Mol. Formula:
C14H15N3O2

M.W.:
257.29

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
2.31

Polar Surface Area:
48.53

HBA:
5

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.66

DETAILS

ALA1088677

Name:
2-Methylimidazo[1,2-a]pyrrolo[3,2-c]pyridine-8-car
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Mol. Formula:
C11H9N3O2

M.W.:
215.21

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
1.82

Polar Surface Area:
70.39

HBA:
3

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.65

DETAILS

ALA1088676

Name:
8-Hydroxymethyl-2-methylimidazo[1,2-a]pyrrolo[3,2-
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Mol. Formula:
C11H11N3O

M.W.:
201.23

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
1.62

Polar Surface Area:
53.32

HBA:
3

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
Y

QED Weighted:
0.63

DETAILS

ALA1088675

Name:
Ethyl 2-(N,N-dimethylaminomethyl)imidazo[1,2-a]pyr
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Mol. Formula:
C15H18N4O2

M.W.:
286.34

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
2.05

Polar Surface Area:
62.63

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.75

DETAILS

ALA1088674

Name:
Ethyl 2-chloromethylimidazo[1,2-a]pyrrolo[3,2-c]py
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Mol. Formula:
C13H12ClN3O2

M.W.:
277.71

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
2.73

Polar Surface Area:
59.39

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.59

DETAILS

ALA1088242

Name:
Ethyl 2-hydroxymethylimidazo[1,2-a]pyrrolo[3,2-c]p
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Mol. Formula:
C13H13N3O3

M.W.:
259.26

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
1.48

Polar Surface Area:
79.62

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.70

DETAILS

ALA1094053

Name:
Ethyl 2-formylimidazo[1,2-a]pyrrolo[3,2-c]pyridine
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Mol. Formula:
C13H11N3O3

M.W.:
257.25

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
1.80

Polar Surface Area:
76.46

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.57

DETAILS

ALA1088110

Name:
Ethyl 2-diethoxymethylimidazo[1,2-a]pyrrolo[3,2-c]
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Mol. Formula:
C17H21N3O4

M.W.:
331.37

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
3.06

Polar Surface Area:
77.85

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.53

DETAILS

ALA1087599

Name:
Ethyl 2-methyl-3-nitroimidazo[1,2-a]pyrrolo[3,2-c]
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Mol. Formula:
C13H12N4O4

M.W.:
288.26

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
2.21

Polar Surface Area:
102.53

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.45

DETAILS

ALA1088663

Name:
Ethyl 3-bromo-2-methylimidazo[1,2-a]pyrrolo[3,2-c]
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Mol. Formula:
C13H12BrN3O2

M.W.:
322.16

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
3.06

Polar Surface Area:
59.39

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.74

DETAILS

ALA1099041

Name:
Ethyl 3-bromoimidazo[1,2-a]pyrrolo[3,2-c]pyridine-
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Mol. Formula:
C12H10BrN3O2

M.W.:
308.14

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
2.75

Polar Surface Area:
59.39

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.74

DETAILS

ALA1088662

Name:
Ethyl 2-tert-butylimidazo[1,2-a]pyrrolo[3,2-c]pyri
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Mol. Formula:
C16H19N3O2

M.W.:
285.35

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
3.29

Polar Surface Area:
59.39

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.73

DETAILS

ALA1088365

Name:
Ethyl 2-iso-propylimidazo[1,2-a]pyrrolo[3,2-c]pyri
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Mol. Formula:
C15H17N3O2

M.W.:
271.32

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
3.12

Polar Surface Area:
59.39

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.74

DETAILS

ALA1088364

Name:
Ethyl 2-trifluoromethylimidazo[1,2-a]pyrrolo[3,2-c
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Mol. Formula:
C13H10F3N3O2

M.W.:
297.24

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
3.01

Polar Surface Area:
59.39

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.74

DETAILS

ALA1088231

Name:
Ethyl 2-(3-methoxyphenyl)imidazo[1,2-a]pyrrolo[3,2
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Mol. Formula:
C19H17N3O3

M.W.:
335.36

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
3.67

Polar Surface Area:
68.62

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.58

DETAILS

ALA1088230

Name:
Ethyl 2-phenylimidazo[1,2-a]pyrrolo[3,2-c]pyridine
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Mol. Formula:
C18H15N3O2

M.W.:
305.34

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
3.66

Polar Surface Area:
59.39

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.59

DETAILS

ALA1088229

Name:
Ethyl 2-methylimidazo[1,2-a]pyrrolo[3,2-c]pyridine
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Mol. Formula:
C13H13N3O2

M.W.:
243.27

3 activity values

3 unique targets

Type:
Small molecule

AlogP:
2.30

Polar Surface Area:
59.39

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.70

DETAILS