Compounds

Type:
Unknown

AlogP:
3.69

Polar Surface Area:
54.26

HBA:
3

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.57

DETAILS

ALA4534503

Name:
tert-Butyl((1-(4-(Hydroxycarbamoyl)benzyl)-1H-indo
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Mol. Formula:
C22H25N3O4

M.W.:
395.46

Type:
Unknown

AlogP:
3.83

Polar Surface Area:
92.59

HBA:
5

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.45

DETAILS

ALA4532181

Name:
(+/-)-N-Hydroxy-4-((3-(1-methylpyrrolidin-2-yl)-1H
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Mol. Formula:
C21H23N3O2

M.W.:
349.43

Type:
Unknown

AlogP:
3.58

Polar Surface Area:
57.50

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.56

DETAILS

ALA4531802

Name:
4-((3,4-Dihydropyrano[4,3-b]indol-5(1H)-yl)methyl)
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Mol. Formula:
C19H18N2O3

M.W.:
322.36

Type:
Unknown

AlogP:
2.88

Polar Surface Area:
63.49

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.58

DETAILS

ALA4548759

Name:
N1-(4-(3-acetamidophenyl)thiazol-2-yl)-N7-(2-amino
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Mol. Formula:
C24H27N5O3S

M.W.:
465.58

Type:
Unknown

AlogP:
4.88

Polar Surface Area:
126.21

HBA:
6

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.25

DETAILS

ALA4744479

Name:
4-((4aS,10R)-10,10-Dioxo-1,2,3,4,4a,10,11,11a-octa
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Mol. Formula:
C21H24N2O4S

M.W.:
400.50

11 activity values

11 unique targets

Type:
Unknown

AlogP:
3.16

Polar Surface Area:
86.71

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.61

DETAILS

ALA4759256

Name:
6-(5-(dimethylamino)naphthalene-1-sulfonamido)-N-h
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Mol. Formula:
C18H25N3O4S

M.W.:
379.48

4 unique targets

Type:
Unknown

AlogP:
2.25

Polar Surface Area:
98.74

HBA:
5

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.35

DETAILS

ALA4578278

Name:
N-Hydroxy-4-((3-(pyrrolidin-1-ylmethyl)-1H-Indol-1
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Mol. Formula:
C21H23N3O2

M.W.:
349.43

Type:
Unknown

AlogP:
3.40

Polar Surface Area:
57.50

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.55

DETAILS

ALA4468860

Name:
4-((2-(tert-Butyl)-1H-indol-1-yl)methyl)-N-hydroxy
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Mol. Formula:
C20H22N2O2

M.W.:
322.41

Type:
Unknown

AlogP:
4.11

Polar Surface Area:
54.26

HBA:
3

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.56

DETAILS

ALA4466930

Name:
N-Hydroxy-4-((3-(2-hydroxyethyl)-1H-indol-1-yl)met
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Mol. Formula:
C18H18N2O3

M.W.:
310.35

Type:
Unknown

AlogP:
2.34

Polar Surface Area:
74.49

HBA:
4

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.50

DETAILS

ALA4464421

Name:
ethyl 3-(2-(7-(hydroxyamino)-7-oxoheptanamido)thia
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Mol. Formula:
C19H24N4O5S

M.W.:
420.49

Type:
Unknown

AlogP:
3.77

Polar Surface Area:
129.65

HBA:
7

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.26

DETAILS

ALA4470067

Name:
4-((3-((Dimethylamino)methyl)-1H-indazol-1-yl)meth
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Mol. Formula:
C18H20N4O2

M.W.:
324.38

Type:
Unknown

AlogP:
2.27

Polar Surface Area:
70.39

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.56

DETAILS

ALA4551095

Name:
ethyl 3-(2-(7-(2-aminophenylamino)-7-oxoheptanamid
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Mol. Formula:
C25H29N5O4S

M.W.:
495.61

Type:
Unknown

AlogP:
5.49

Polar Surface Area:
135.44

HBA:
7

HBD:
4

#RO5 Violations:
1

#Rotatable Bonds:
11

Passes Ro3:
N

QED Weighted:
0.21

DETAILS

ALA4550526

Name:
tert-butyl 3-(2-(7-(hydroxyamino)-7-oxoheptanamido
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Mol. Formula:
C21H28N4O5S

M.W.:
448.55

Type:
Unknown

AlogP:
4.55

Polar Surface Area:
129.65

HBA:
7

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.25

DETAILS

ALA4545091

Name:
tert-butyl 3-(2-(7-(2-aminophenylamino)-7-oxohepta
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Mol. Formula:
C27H33N5O4S

M.W.:
523.66

Type:
Unknown

AlogP:
6.27

Polar Surface Area:
135.44

HBA:
7

HBD:
4

#RO5 Violations:
2

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.18

DETAILS

ALA4562244

Name:
4-((2-Acetyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5(2
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Mol. Formula:
C21H21N3O3

M.W.:
363.42

Type:
Unknown

AlogP:
2.71

Polar Surface Area:
74.57

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.55

DETAILS

ALA4541796

Name:
N-Hydroxy-4-((3-(1-methyl-1H-imidazol-5-yl)-1H-ind
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Mol. Formula:
C20H18N4O2

M.W.:
346.39

8 activity values

Type:
Unknown

AlogP:
3.21

Polar Surface Area:
72.08

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.44

DETAILS

ALA4593729

Name:
N1-(2-aminophenyl)-N7-(4-(3-aminophenyl)thiazol-2-
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Mol. Formula:
C22H25N5O2S

M.W.:
423.54

Type:
Unknown

AlogP:
4.50

Polar Surface Area:
123.13

HBA:
6

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.30

DETAILS

ALA4445881

Name:
N-hydroxy-4-((3-(2-methoxyethyl)-1H-indol-1-yl)met
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Mol. Formula:
C19H20N2O3

M.W.:
324.38

Type:
Unknown

AlogP:
3.00

Polar Surface Area:
63.49

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.54

DETAILS

ALA4438279

Name:
4-((3,4-Dihydrothiopyrano[4,3-b]indol-5(1H)-yl)met
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Mol. Formula:
C19H18N2O2S

M.W.:
338.43