Compounds

Type:
Unknown

AlogP:
4.27

Polar Surface Area:
57.51

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.56

DETAILS

ALA4591969

Name:
2-[N'-(4-Bromobenzylidene)hydrazino]-4-methylthiazole-5-carboxylic acid ethShow More⌵

Mol. Formula:
C14H14BrN3O2S

M.W.:
368.26

Type:
Unknown

AlogP:
3.84

Polar Surface Area:
63.58

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.49

DETAILS

ALA4588301

Name:
2-[(4-Phenylthiazol-2-yl)hydrazonomethyl]phenol

Mol. Formula:
C16H13N3OS

M.W.:
295.37

Type:
Unknown

AlogP:
3.96

Polar Surface Area:
57.51

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.57

DETAILS

ALA4587509

Name:
N-(4-Hexyloxy-3-methoxybenzylidene)-N'-thiazol-2-yl-hydrazine

Mol. Formula:
C17H23N3O2S

M.W.:
333.46

Type:
Unknown

AlogP:
4.56

Polar Surface Area:
55.74

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.39

DETAILS

ALA4583445

Name:
1-(2-{N'-[4-(2-Chlorobenzyloxy)-3-methoxybenzylidene]hydrazino}-4-methylthiShow More⌵

Mol. Formula:
C21H20ClN3O3S

M.W.:
429.93

Type:
Unknown

AlogP:
5.34

Polar Surface Area:
72.81

HBA:
7

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.30

DETAILS

ALA4583170

Name:
2-[N'-(2-Bromobenzylidene)hydrazino]-4-methylthiazole-5-carboxylic acid ethShow More⌵

Mol. Formula:
C14H14BrN3O2S

M.W.:
368.26

Type:
Unknown

AlogP:
3.84

Polar Surface Area:
63.58

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.49

DETAILS

ALA4577334

Name:
4-Methyl-2-[N'-(2-trifluoromethylbenzylidene)hydrazino]thiazole-5-carboxyliShow More⌵

Mol. Formula:
C15H14F3N3O2S

M.W.:
357.36

Type:
Unknown

AlogP:
4.09

Polar Surface Area:
63.58

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.50

DETAILS

ALA4575429

Name:
2-[N'-(3,5-Dibromo-4-hydroxybenzylidene)hydrazino]-4-methylthiazole-5-carboShow More⌵

Mol. Formula:
C14H13Br2N3O3S

M.W.:
463.15

Type:
Unknown

AlogP:
4.30

Polar Surface Area:
83.81

HBA:
7

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.39

DETAILS

ALA4574212

Name:
4-Bromo-2-[(4-methylthiazol-2-yl)hydrazonomethyl]phenol

Mol. Formula:
C11H10BrN3OS

M.W.:
312.19

Type:
Unknown

AlogP:
3.37

Polar Surface Area:
57.51

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.67

DETAILS

ALA4570434

Name:
4-Methyl-2-[N'-(4-nitrobenzylidene)hydrazino]thiazole-5-carboxylic acid metShow More⌵

Mol. Formula:
C13H12N4O4S

M.W.:
320.33

Type:
Unknown

AlogP:
2.59

Polar Surface Area:
106.72

HBA:
8

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.39

DETAILS

ALA4559160

Name:
2-[N'-(4-Bromobenzylidene)hydrazino]-4-methylthiazole-5-carboxylic acid metShow More⌵

Mol. Formula:
C13H12BrN3O2S

M.W.:
354.23

Type:
Unknown

AlogP:
3.45

Polar Surface Area:
63.58

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA4557148

Name:
N-(2-Bromobenzylidene)-N'-[4-(3-nitrophenyl)thiazol-2-yl]hydrazine

Mol. Formula:
C16H11BrN4O2S

M.W.:
403.26

12 activity values

Type:
Unknown

AlogP:
4.93

Polar Surface Area:
80.42

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.37

DETAILS

ALA4555781

Name:
2-[N'-(4-Carboxybenzylidene)hydrazino]-4-methylthiazole-5-carboxylic acid eShow More⌵

Mol. Formula:
C15H15N3O4S

M.W.:
333.37

Type:
Unknown

AlogP:
2.77

Polar Surface Area:
100.88

HBA:
7

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.48

DETAILS

ALA4529777

Name:
N-(4,5-Dimethylthiazol-2-yl)-N'-(4-methoxybenzylidene)hydrazine

Mol. Formula:
C13H15N3OS

M.W.:
261.35

Type:
Unknown

AlogP:
3.21

Polar Surface Area:
46.51

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.68

DETAILS

ALA4528499

Name:
4-[(4-Ethoxycarbonylmethyl-thiazol-2-yl)hydrazonomethyl]benzoic acid

Mol. Formula:
C15H15N3O4S

M.W.:
333.37

Type:
Unknown

AlogP:
2.39

Polar Surface Area:
100.88

HBA:
7

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.46

DETAILS

ALA4521204

Name:
N-(2-Nitrobenzylidene)-N'-thiazol-2-yl-hydrazine

Mol. Formula:
C10H8N4O2S

M.W.:
248.27

Type:
Unknown

AlogP:
2.50

Polar Surface Area:
80.42

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.51

DETAILS

ALA4483579

Name:
2-methoxy-6-nitro-4-[[[4-(4-nitrophenyl)thiazol-2-yl]hydrazono]methyl]phenoShow More⌵

Mol. Formula:
C17H13N5O6S

M.W.:
415.39

12 activity values

Type:
Unknown

AlogP:
3.79

Polar Surface Area:
153.02

HBA:
10

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.34

DETAILS

ALA4475261

Name:
N-[4-(2-Chlorobenzyloxy)-3-methoxybenzylidene]-N'-thiazol-2-yl-hydrazine

Mol. Formula:
C18H16ClN3O2S

M.W.:
373.87

Type:
Unknown

AlogP:
4.83

Polar Surface Area:
55.74

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.48

DETAILS

ALA4471730

Name:
N-(4-Benzyloxy-3-bromo-5-methoxybenzylidene)-N'-thiazol-2-yl-hydrazine

Mol. Formula:
C18H16BrN3O2S

M.W.:
418.32

Type:
Unknown

AlogP:
4.94

Polar Surface Area:
55.74

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.44

DETAILS

ALA4471498

Name:
2,4-Dichlorobenzoic acid 2-methoxy-4-(thiazol-2-ylhydrazonomethyl)phenyl esShow More⌵

Mol. Formula:
C18H13Cl2N3O3S

M.W.:
422.29