Compounds

ALA5267469

Name:
2-(2-Bromo-3,4,5-trimethoxy-benzylidene)-6,9-dimethoxy-tetralone

Mol. Formula:
C22H23BrO6

M.W.:
463.32

Type:
---

AlogP:
4.70

Polar Surface Area:
63.22

HBA:
6

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.58

DETAILS

ALA5266713

Name:
2-(2-chloro-3-methoxybenzylidene)-5,8-dimethoxy-3,4-dihydronaphthalen-1(2H)Show More⌵

Mol. Formula:
C20H19ClO4

M.W.:
358.82

Type:
---

AlogP:
4.58

Polar Surface Area:
44.76

HBA:
4

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.75

DETAILS

ALA5282265

Name:
2-(2-Bromo-3,4,5-trimethoxy-benzylidene)-7,8-dimethoxy-tetralone

Mol. Formula:
C22H23BrO6

M.W.:
463.32

Type:
---

AlogP:
4.70

Polar Surface Area:
63.22

HBA:
6

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.58

DETAILS

ALA5281589

Name:
2-(2-chloro-3,4-dimethoxybenzylidene)-7-nitro-3,4-dihydronaphthalen-1(2H)-oShow More⌵

Mol. Formula:
C19H17ClN2O5

M.W.:
388.81

Type:
---

AlogP:
4.47

Polar Surface Area:
94.19

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.47

DETAILS

ALA5281240

Name:
7-bromo-2-(2-bromo-3,4,5-trimethoxybenzylidene)-3,4-dihydronaphthalen-1(2H)Show More⌵

Mol. Formula:
C20H18Br2O4

M.W.:
482.17

Type:
---

AlogP:
5.45

Polar Surface Area:
44.76

HBA:
4

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.54

DETAILS

ALA5281118

Name:
2-(2-bromo-3,4,5-trimethoxybenzylidene)-7-nitro-3,4-dihydronaphthalen-1(2H)Show More⌵

Mol. Formula:
C20H19BrN2O6

M.W.:
463.28

Type:
---

AlogP:
4.59

Polar Surface Area:
103.42

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.40

DETAILS

ALA5280878

Name:
6-methoxy-2-(3-methoxybenzylidene)-3,4-dihydronaphthalen-1(2H)-one

Mol. Formula:
C19H17ClO3

M.W.:
328.80

Type:
---

AlogP:
4.57

Polar Surface Area:
35.53

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.77

DETAILS

ALA5280752

Name:
3,5-Bis(2-bromo-3,4,5-trimethoxy-benzylidene)-1-methyl-cyclohexanone O-2-(dShow More⌵

Mol. Formula:
C33H44Br2N2O7

M.W.:
740.53

Type:
---

AlogP:
7.87

Polar Surface Area:
80.21

HBA:
9

HBD:
---

#RO5 Violations:
2

#Rotatable Bonds:
14

Passes Ro3:
N

QED Weighted:
0.14

DETAILS

ALA5280635

Name:
3-ethyl-5-methyl-N-(4-morpholinophenethyl)-1H-indole-2-carboxamide

Mol. Formula:
C24H29N3O2

M.W.:
391.52

Type:
---

AlogP:
3.85

Polar Surface Area:
57.36

HBA:
3

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.67

DETAILS

ALA5280607

Name:
2-(2-chloro-3,4-dimethoxybenzylidene)-7-nitro-3,4-dihydronaphthalen-1(2H)-oShow More⌵

Mol. Formula:
C25H30ClN3O5

M.W.:
487.98

Type:
---

AlogP:
5.36

Polar Surface Area:
86.43

HBA:
7

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.25

DETAILS

ALA5280593

Name:
(3-ethyl-5-methyl-1H-indol-2-yl)(4-phenylpiperazin-1-yl)methanone

Mol. Formula:
C22H25N3O

M.W.:
347.46

Type:
---

AlogP:
4.00

Polar Surface Area:
39.34

HBA:
2

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.78

DETAILS

ALA5280441

Name:
2-(2-bromo-3,4,5-trimethoxybenzylidene)-7-fluoro-3,4-dihydronaphthalen-1(2HShow More⌵

Mol. Formula:
C20H18BrFO4

M.W.:
421.26

Type:
---

AlogP:
4.83

Polar Surface Area:
44.76

HBA:
4

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.66

DETAILS

ALA5280015

Name:
2-(2-chloro-3,4-dimethoxybenzylidene)-4-methyl-3,4-dihydronaphthalen-1(2H)-Show More⌵

Mol. Formula:
C20H19ClO3

M.W.:
342.82

Type:
---

AlogP:
5.13

Polar Surface Area:
35.53

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.73

DETAILS

ALA5279993

Name:
2-(2-bromo-3,4,5-trimethoxybenzylidene)-7-nitro-3,4-dihydronaphthalen-1(2H)Show More⌵

Mol. Formula:
C26H32BrN3O6

M.W.:
562.46

Type:
---

AlogP:
5.48

Polar Surface Area:
95.66

HBA:
8

HBD:
---

#RO5 Violations:
2

#Rotatable Bonds:
11

Passes Ro3:
N

QED Weighted:
0.20

DETAILS

ALA5279992

Name:
2-(2-bromo-3,4,5-trimethoxybenzylidene)-6,7-dimethoxy-3,4-dihydronaphthalenShow More⌵

Mol. Formula:
C22H24BrNO6

M.W.:
478.34

Type:
---

AlogP:
4.70

Polar Surface Area:
78.74

HBA:
7

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.48

DETAILS

ALA5279828

Name:
7-bromo-2-(2-chloro-3,4-dimethoxybenzylidene)-3,4-dihydronaphthalen-1(2H)-oShow More⌵

Mol. Formula:
C19H16BrClO3

M.W.:
407.69

Type:
---

AlogP:
5.33

Polar Surface Area:
35.53

HBA:
3

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.64

DETAILS

ALA5279636

Name:
3,5-bis(2-bromo-3,4,5-trimethoxybenzylidene)-1-methylpiperidin-4-one oxime

Mol. Formula:
C26H30Br2N2O7

M.W.:
642.34

Type:
---

AlogP:
5.51

Polar Surface Area:
91.21

HBA:
9

HBD:
1

#RO5 Violations:
2

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.30

DETAILS

ALA5278901

Name:
2-(2-chloro-3-methoxybenzylidene)-5-methoxy-3,4-dihydronaphthalen-1(2H)-one

Mol. Formula:
C19H17ClO3

M.W.:
328.80

Type:
---

AlogP:
4.57

Polar Surface Area:
35.53

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.77

DETAILS

ALA5278824

Name:
(5-bromo-3-ethyl-1H-indol-2-yl)(4-phenylpiperazin-1-yl)methanone

Mol. Formula:
C21H22BrN3O

M.W.:
412.33

Type:
---

AlogP:
4.46

Polar Surface Area:
39.34

HBA:
2

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.69

DETAILS

ALA5278540

Name:
2-(2-Bromo-3,4,5-trimethoxy-benzylidene)-7-methoxy-tetralone

Mol. Formula:
C21H21BrO5

M.W.:
433.30

Type:
---

AlogP:
4.70

Polar Surface Area:
53.99

HBA:
5

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.64

DETAILS