Compounds

ALA5272263

Name:
5-(4-fluorophenyl)-1-((3R,5aS,6R,8aS,9R,10R,12R,12aR)-3,6,9-trimethyldecahyShow More⌵

Mol. Formula:
C23H28FN3O4

M.W.:
429.49

Type:
---

AlogP:
4.46

Polar Surface Area:
67.63

HBA:
7

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.66

DETAILS

ALA5271402

Name:
(6R,9aR)-N,6-dibenzyl-8-(naphthalen-1-ylmethyl)-4,7-dioxohexahydro-2H-pyrazShow More⌵

Mol. Formula:
C33H32N4O3

M.W.:
532.64

Type:
---

AlogP:
4.56

Polar Surface Area:
72.96

HBA:
3

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.40

DETAILS

ALA5269928

Name:
4-(2-(trifluoromethyl)phenyl)-1-((3R,5aS,6R,8aS,9R,10R,12R,12aR)-3,6,9-trimShow More⌵

Mol. Formula:
C24H28F3N3O4

M.W.:
479.50

Type:
---

AlogP:
5.34

Polar Surface Area:
67.63

HBA:
7

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.54

DETAILS

ALA5268416

Name:
4-(4-fluorophenyl)-1-((3R,5aS,6R,8aS,9R,12R,12aR)-3,6,9-trimethyldecahydro-Show More⌵

Mol. Formula:
C23H28FN3O4

M.W.:
429.49

Type:
---

AlogP:
4.46

Polar Surface Area:
67.63

HBA:
7

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.66

DETAILS

ALA5267989

Name:
6-bromo-N'-(2-hydroxybenzylidene)-2-methylquinoline-4-carbohydrazide

Mol. Formula:
C18H14BrN3O2

M.W.:
384.23

Type:
---

AlogP:
3.78

Polar Surface Area:
74.58

HBA:
4

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.53

DETAILS

ALA5281729

Name:
4-(p-tolyl)-1-((3R,5aS,6R,8aS,9S,10S,12R,12aR)-3,6,9-trimethyldecahydro-3H-Show More⌵

Mol. Formula:
C24H31N3O4

M.W.:
425.53

Type:
---

AlogP:
4.63

Polar Surface Area:
67.63

HBA:
7

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.65

DETAILS

ALA5278135

Name:
N'-(1-(2-hydroxy-4-methylphenyl)propylidene)-2-((2-morpholinoethyl)amino)isShow More⌵

Mol. Formula:
C22H29N5O3

M.W.:
411.51

Type:
---

AlogP:
2.38

Polar Surface Area:
99.08

HBA:
7

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.46

DETAILS

ALA5277799

Name:
5-(4-chlorophenyl)-1-((3R,5aS,6R,8aS,9R,10R,12R,12aR)-3,6,9-trimethyldecahyShow More⌵

Mol. Formula:
C23H28ClN3O4

M.W.:
445.95

Type:
---

AlogP:
4.98

Polar Surface Area:
67.63

HBA:
7

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.61

DETAILS

ALA5277421

Name:
4-(4-pentylphenyl)-1-((3R,5aS,6R,8aS,9S,10S,12R,12aR)-3,6,9-trimethyldecahyShow More⌵

Mol. Formula:
C28H39N3O4

M.W.:
481.64

Type:
---

AlogP:
6.06

Polar Surface Area:
67.63

HBA:
7

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.37

DETAILS

ALA5276511

Name:
4-(3,5-difluorophenyl)-1-((3R,5aS,6R,8aS,9S,10S,12R,12aR)-3,6,9-trimethyldeShow More⌵

Mol. Formula:
C23H27F2N3O4

M.W.:
447.48

Type:
---

AlogP:
4.60

Polar Surface Area:
67.63

HBA:
7

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.63

DETAILS

ALA5276391

Name:
5-(3,5-difluorophenyl)-1-((3R,5aS,6R,8aS,9R,10R,12R,12aR)-3,6,9-trimethyldeShow More⌵

Mol. Formula:
C23H27F2N3O4

M.W.:
447.48

Type:
---

AlogP:
4.60

Polar Surface Area:
67.63

HBA:
7

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.63

DETAILS

ALA5275764

Name:
5-Fluorouridine

Mol. Formula:
C9H11FN2O6

M.W.:
262.19

Type:
---

AlogP:
-2.71

Polar Surface Area:
124.78

HBA:
7

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.46

DETAILS

ALA5285952

Name:
4-(4-fluorophenyl)-1-((3R,5aS,6R,8aS,9S,10S,12R,12aR)-3,6,9-trimethyldecahyShow More⌵

Mol. Formula:
C23H28FN3O4

M.W.:
429.49

Type:
---

AlogP:
4.46

Polar Surface Area:
67.63

HBA:
7

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.66

DETAILS

ALA5285517

Name:
4-(4-methoxyphenyl)-1-((3R,5aS,6R,8aS,9S,10S,12R,12aR)-3,6,9-trimethyldecahShow More⌵

Mol. Formula:
C24H31N3O5

M.W.:
441.53

Type:
---

AlogP:
4.33

Polar Surface Area:
76.86

HBA:
8

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.66

DETAILS

ALA5283746

Name:
5-(p-tolyl)-1-((3R,5aS,6R,8aS,9R,10R,12R,12aR)-3,6,9-trimethyldecahydro-3H-Show More⌵

Mol. Formula:
C24H31N3O4

M.W.:
425.53

Type:
---

AlogP:
4.63

Polar Surface Area:
67.63

HBA:
7

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.65

DETAILS

ALA5290596

Name:
5-(4-methoxyphenyl)-1-((3R,5aS,6R,8aS,9R,10R,12R,12aR)-3,6,9-trimethyldecahShow More⌵

Mol. Formula:
C24H31N3O5

M.W.:
441.53

Type:
---

AlogP:
4.33

Polar Surface Area:
76.86

HBA:
8

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.66

DETAILS

ALA5290294

Name:
5-bromo-N-(2,3-dihydroxypropoxy)-2-((2,4-dimethylphenyl)amino)-3,4-dimethylShow More⌵

Mol. Formula:
C20H25BrN2O4

M.W.:
437.33

Type:
---

AlogP:
3.44

Polar Surface Area:
90.82

HBA:
5

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.50

DETAILS

ALA5289212

Name:
5-phenyl-1-((3R,5aS,6R,8aS,9R,10R,12R,12aR)-3,6,9-trimethyldecahydro-3H-3,1Show More⌵

Mol. Formula:
C23H29N3O4

M.W.:
411.50

Type:
---

AlogP:
4.33

Polar Surface Area:
67.63

HBA:
7

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.69

DETAILS

ALA5288801

Name:
5-(4-pentylphenyl)-1-((3R,5aS,6R,8aS,9R,10R,12R,12aR)-3,6,9-trimethyldecahyShow More⌵

Mol. Formula:
C28H39N3O4

M.W.:
481.64

Type:
---

AlogP:
6.06

Polar Surface Area:
67.63

HBA:
7

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.37

DETAILS

ALA5288728

Name:
4-(2-(trifluoromethyl)phenyl)-1-((3R,5aS,6R,8aS,9S,10S,12R,12aR)-3,6,9-trimShow More⌵

Mol. Formula:
C24H28F3N3O4

M.W.:
479.50

Type:
---

AlogP:
5.34

Polar Surface Area:
67.63

HBA:
7

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.54

DETAILS