Compounds

ALA5272640

Name:
3-((3,5-Dimethyl-4-(4-((o-tolyloxy)methyl)benzamido)-1H-pyrazol-1-yl)methylShow More⌵

Mol. Formula:
C29H30N4O3

M.W.:
482.58

Type:
---

AlogP:
5.05

Polar Surface Area:
85.25

HBA:
5

HBD:
2

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.37

DETAILS

ALA5272447

Name:
3-((3,5-Dimethyl-4-(4-((m-tolyloxy)methyl)benzamido)-1H-pyrazol-1-yl)methylShow More⌵

Mol. Formula:
C29H30N4O3

M.W.:
482.58

Type:
---

AlogP:
5.05

Polar Surface Area:
85.25

HBA:
5

HBD:
2

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.37

DETAILS

ALA5272058

Name:
3-((3,5-Dimethyl-4-(4-(phenoxymethyl)benzamido)-1H-pyrazol-1-yl)methyl)-N-eShow More⌵

Mol. Formula:
C29H30N4O3

M.W.:
482.58

Type:
---

AlogP:
5.13

Polar Surface Area:
85.25

HBA:
5

HBD:
2

#RO5 Violations:
1

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.35

DETAILS

ALA5271675

Name:
3-((4-(4-((Cyclohexyloxy)methyl)benzamido)-3,5-dimethyl-1H-pyrazol-1-yl)metShow More⌵

Mol. Formula:
C28H34N4O3

M.W.:
474.61

Type:
---

AlogP:
5.01

Polar Surface Area:
85.25

HBA:
5

HBD:
2

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.48

DETAILS

ALA5270263

Name:
3-((3,5-Dimethyl-4-(4-(phenoxymethyl)benzamido)-1H-pyrazol-1-yl)methyl)-N-pShow More⌵

Mol. Formula:
C33H30N4O3

M.W.:
530.63

Type:
---

AlogP:
6.63

Polar Surface Area:
85.25

HBA:
5

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.22

DETAILS

ALA5269976

Name:
N-(1-(4-Carbamoylbenzyl)-3,5-dimethyl-1H-pyrazol-4-yl)-4-(phenoxymethyl)benShow More⌵

Mol. Formula:
C27H26N4O3

M.W.:
454.53

Type:
---

AlogP:
4.48

Polar Surface Area:
99.24

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.41

DETAILS

ALA5268313

Name:
4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl((2S,3S,4S,6R)-3-hydroShow More⌵

Mol. Formula:
C41H46BNO15

M.W.:
803.62

Type:
---

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA5268013

Name:
3-((4-(4-((4-Chlorophenoxy)methyl)benzamido)-3,5-dimethyl-1H-pyrazol-1-yl)mShow More⌵

Mol. Formula:
C28H27ClN4O3

M.W.:
503.00

Type:
---

AlogP:
5.39

Polar Surface Area:
85.25

HBA:
5

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.34

DETAILS

ALA5281419

Name:
3-((3,5-Dimethyl-4-(4-((2-methyl-4-(trifluoromethyl)phenoxy)methyl)benzamidShow More⌵

Mol. Formula:
C30H29F3N4O3

M.W.:
550.58

Type:
---

AlogP:
6.07

Polar Surface Area:
85.25

HBA:
5

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.28

DETAILS

ALA5280874

Name:
3-(4-(7-methoxynaphthalen-1-yl)-1H-1,2,3-triazol-1-yl)propyl 9-chloro-2,3-dShow More⌵

Mol. Formula:
C30H30ClN3O3

M.W.:
516.04

Type:
---

AlogP:
6.64

Polar Surface Area:
66.24

HBA:
6

HBD:
---

#RO5 Violations:
2

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.20

DETAILS

ALA5279153

Name:
N-(1-(2-Carbamoylbenzyl)-3,5-dimethyl-1H-pyrazol-4-yl)-4-(phenoxymethyl)benShow More⌵

Mol. Formula:
C27H26N4O3

M.W.:
454.53

Type:
---

AlogP:
4.48

Polar Surface Area:
99.24

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.41

DETAILS

ALA5278863

Name:
2,9-bis((3-(diethylamino)propyl)amino)-5-methyl-11H-indolo[3,2-c]quinolin-5Show More⌵

Mol. Formula:
C30H45N6+

M.W.:
489.73

Type:
---

AlogP:
5.59

Polar Surface Area:
50.21

HBA:
4

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
14

Passes Ro3:
N

QED Weighted:
0.16

DETAILS

ALA5278154

Name:
3-((3,5-Dimethyl-4-(4-((p-tolyloxy)methyl)benzamido)-1H-pyrazol-1-yl)methylShow More⌵

Mol. Formula:
C29H30N4O3

M.W.:
482.58

Type:
---

AlogP:
5.05

Polar Surface Area:
85.25

HBA:
5

HBD:
2

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.37

DETAILS

ALA5277958

Name:
(3aS,4R,6S,6aR)-5-butyl-6-(hydroxymethyl)-2,2,6-trimethyl-N-((Z)-octadec-9-Show More⌵

Mol. Formula:
C32H60N2O4

M.W.:
536.84

Type:
---

AlogP:
6.90

Polar Surface Area:
71.03

HBA:
5

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
21

Passes Ro3:
N

QED Weighted:
0.12

DETAILS

ALA5277265

Name:
N-(1-(3-Carbamoylbenzyl)-3,5-dimethyl-1H-pyrazol-4-yl)-4-(phenoxymethyl)benShow More⌵

Mol. Formula:
C27H26N4O3

M.W.:
454.53

Type:
---

AlogP:
4.48

Polar Surface Area:
99.24

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.41

DETAILS

ALA5277208

Name:
N-(1-Benzyl-3,5-dimethyl-1H-pyrazol-4-yl)-4-(phenoxymethyl)benzamide

Mol. Formula:
C26H25N3O2

M.W.:
411.51

Type:
---

AlogP:
5.38

Polar Surface Area:
56.15

HBA:
4

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.44

DETAILS

ALA5275466

Name:
3-((3,5-Dimethyl-4-(4-((2-(trifluoromethyl)phenoxy)methyl)benzamido)-1H-pyrShow More⌵

Mol. Formula:
C29H27F3N4O3

M.W.:
536.55

Type:
---

AlogP:
5.76

Polar Surface Area:
85.25

HBA:
5

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.30

DETAILS

ALA5275176

Name:
3-((4-(4-((2-Chlorophenoxy)methyl)benzamido)-3,5-dimethyl-1H-pyrazol-1-yl)mShow More⌵

Mol. Formula:
C28H27ClN4O3

M.W.:
503.00

Type:
---

AlogP:
5.39

Polar Surface Area:
85.25

HBA:
5

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.34

DETAILS

ALA5273744

Name:
3-((4-(4-((3-Chlorophenoxy)methyl)benzamido)-3,5-dimethyl-1H-pyrazol-1-yl)mShow More⌵

Mol. Formula:
C28H27ClN4O3

M.W.:
503.00

Type:
---

AlogP:
5.39

Polar Surface Area:
85.25

HBA:
5

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.34

DETAILS

ALA5273505

Name:
3-((3,5-Dimethyl-4-(4-((3-(trifluoromethyl)phenoxy)methyl)benzamido)-1H-pyrShow More⌵

Mol. Formula:
C29H27F3N4O3

M.W.:
536.55

Type:
---

AlogP:
5.76

Polar Surface Area:
85.25

HBA:
5

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.30

DETAILS