Compounds

ALA4648636

Name:
(3S,8S,9R,10R,11R,13R,14S,17R)-17-[(1R)-4-(3-imidazol-1-ylpropylamino)-1-meShow More⌵

Mol. Formula:
C33H55N3O2

M.W.:
525.82

1 activity values

1 unique targets

Type:
Unknown

AlogP:
6.22

Polar Surface Area:
70.31

HBA:
5

HBD:
3

#RO5 Violations:
2

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.26

DETAILS

ALA4648563

Name:
(3S,8S,9R,10R,11R,13R,14S,17R)-17-[(1R)-4-[(3,4-dimethoxyphenyl)methylaminoShow More⌵

Mol. Formula:
C36H57NO4

M.W.:
567.86

1 activity values

1 unique targets

Type:
Unknown

AlogP:
7.15

Polar Surface Area:
70.95

HBA:
5

HBD:
3

#RO5 Violations:
2

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.22

DETAILS

ALA4648110

Name:
(3S,8S,9R,10R,11R,13R,14S,17R)-17-[(1R)-4-(benzylamino)-1-methyl-butyl]-4,4Show More⌵

Mol. Formula:
C34H53NO2

M.W.:
507.80

1 activity values

1 unique targets

Type:
Unknown

AlogP:
7.13

Polar Surface Area:
52.49

HBA:
3

HBD:
3

#RO5 Violations:
2

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.27

DETAILS

ALA4646560

Name:
(3S,8S,9R,10R,11R,13R,14S,17R)-4,4,9,13,14-pentamethyl-17-[(1R)-1-methyl-4-Show More⌵

Mol. Formula:
C33H52N2O2

M.W.:
508.79

1 activity values

1 unique targets

Type:
Unknown

AlogP:
6.52

Polar Surface Area:
65.38

HBA:
4

HBD:
3

#RO5 Violations:
2

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.29

DETAILS

ALA4644881

Name:
(3S,8S,9R,10R,11R,13R,14S,17R)-17-[(1R)-4-(4-methoxyanilino)-1-methyl-butylShow More⌵

Mol. Formula:
C34H53NO3

M.W.:
523.80

1 activity values

1 unique targets

Type:
Unknown

AlogP:
7.46

Polar Surface Area:
61.72

HBA:
4

HBD:
3

#RO5 Violations:
2

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.26

DETAILS

ALA4644411

Name:
(3S,8S,9R,10R,11R,13R,14S,17R)-4,4,9,13,14-pentamethyl-17-[(1R)-1-methyl-4-Show More⌵

Mol. Formula:
C35H54N2O4

M.W.:
566.83

1 activity values

1 unique targets

Type:
Unknown

AlogP:
7.08

Polar Surface Area:
95.63

HBA:
5

HBD:
3

#RO5 Violations:
2

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.13

DETAILS

ALA4643614

Name:
(3S,8S,9R,10R,11R,13R,14S,17R)-17-[(1R)-4-(tert-butylamino)-1-methyl-butyl]Show More⌵

Mol. Formula:
C31H55NO2

M.W.:
473.79

1 activity values

1 unique targets

Type:
Unknown

AlogP:
6.73

Polar Surface Area:
52.49

HBA:
3

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.31

DETAILS

ALA4643591

Name:
(3S,8S,9R,10R,11R,13R,14S,17R)-4,4,9,13,14-pentamethyl-17-[(1R)-1-methyl-4-Show More⌵

Mol. Formula:
C33H52N2O2

M.W.:
508.79

1 activity values

1 unique targets

Type:
Unknown

AlogP:
6.52

Polar Surface Area:
65.38

HBA:
4

HBD:
3

#RO5 Violations:
2

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.29

DETAILS

ALA4641632

Name:
(3S,8S,9R,10R,11R,13R,14S,17R)-17-[(1R)-4-[(4-fluorophenyl)methylamino]-1-mShow More⌵

Mol. Formula:
C34H52FNO2

M.W.:
525.79

1 activity values

1 unique targets

Type:
Unknown

AlogP:
7.27

Polar Surface Area:
52.49

HBA:
3

HBD:
3

#RO5 Violations:
2

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.26

DETAILS

ALA4641544

Name:
(3S,8S,9R,10R,11R,13R,14S,17R)-4,4,9,13,14-pentamethyl-17-[(1R)-1-methyl-4-Show More⌵

Mol. Formula:
C33H52N2O2

M.W.:
508.79

1 activity values

1 unique targets

Type:
Unknown

AlogP:
6.52

Polar Surface Area:
65.38

HBA:
4

HBD:
3

#RO5 Violations:
2

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.29

DETAILS

ALA4641375

Name:
(3S,8S,9R,10R,11R,13R,14S,17R)-4,4,9,13,14-pentamethyl-17-[(1R)-1-methyl-4-Show More⌵

Mol. Formula:
C35H55NO2

M.W.:
521.83

1 activity values

1 unique targets

Type:
Unknown

AlogP:
7.17

Polar Surface Area:
52.49

HBA:
3

HBD:
3

#RO5 Violations:
2

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.25

DETAILS

ALA4640795

Name:
(3S,8S,9R,10R,11R,13R,14S,17R)-17-[(1R)-4-(ethylamino)-1-methyl-butyl]-4,4,Show More⌵

Mol. Formula:
C29H51NO2

M.W.:
445.73

1 activity values

1 unique targets

Type:
Unknown

AlogP:
5.95

Polar Surface Area:
52.49

HBA:
3

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.35

DETAILS

ALA4640680

Name:
(3S,8S,9R,10R,11R,13R,14S,17R)-17-[(1R)-4-[2-(3,4-dimethoxyphenyl)ethylaminShow More⌵

Mol. Formula:
C37H59NO4

M.W.:
581.88

1 activity values

1 unique targets

Type:
Unknown

AlogP:
7.19

Polar Surface Area:
70.95

HBA:
5

HBD:
3

#RO5 Violations:
2

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.20

DETAILS

ALA4639939

Name:
(3S,8S,9R,10R,11R,13R,14S,17R)-17-[(1R)-4-[(4-chlorophenyl)methylamino]-1-mShow More⌵

Mol. Formula:
C34H52ClNO2

M.W.:
542.25

1 activity values

1 unique targets

Type:
Unknown

AlogP:
7.78

Polar Surface Area:
52.49

HBA:
3

HBD:
3

#RO5 Violations:
2

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.24

DETAILS

ALA4639889

Name:
(3S,8S,9R,10R,11R,13R,14S,17R)-4,4,9,13,14-pentamethyl-17-[(1R)-1-methyl-4-Show More⌵

Mol. Formula:
C33H59N3O2

M.W.:
529.85

1 activity values

1 unique targets

Type:
Unknown

AlogP:
4.83

Polar Surface Area:
67.76

HBA:
5

HBD:
4

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.27

DETAILS

ALA4638899

Name:
(3S,8S,9R,10R,11R,13R,14S,17R)-4,4,9,13,14-pentamethyl-17-[(1R)-1-methyl-4-Show More⌵

Mol. Formula:
C35H55NO2

M.W.:
521.83

1 activity values

1 unique targets

Type:
Unknown

AlogP:
7.69

Polar Surface Area:
52.49

HBA:
3

HBD:
3

#RO5 Violations:
2

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.25

DETAILS

ALA4637165

Name:
(3S,8S,9R,10R,11R,13R,14S,17R)-4,4,9,13,14-pentamethyl-17-[(1R)-1-methyl-4-Show More⌵

Mol. Formula:
C30H53NO2

M.W.:
459.76

2 activity values

1 unique targets

Type:
Unknown

AlogP:
6.34

Polar Surface Area:
52.49

HBA:
3

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.31

DETAILS

ALA4637006

Name:
(3S,8S,9R,10R,11R,13R,14S,17R)-17-[(1R)-4-(isopropylamino)-1-methyl-butyl]-Show More⌵

Mol. Formula:
C30H53NO2

M.W.:
459.76

2 activity values

1 unique targets

Type:
Unknown

AlogP:
6.34

Polar Surface Area:
52.49

HBA:
3

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.32

DETAILS

ALA4636688

Name:
(3S,8S,9R,10R,11R,13R,14S,17R)-17-[(1R)-4-(cyclopropylamino)-1-methyl-butylShow More⌵

Mol. Formula:
C30H51NO2

M.W.:
457.74

1 activity values

1 unique targets

Type:
Unknown

AlogP:
6.09

Polar Surface Area:
52.49

HBA:
3

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.33

DETAILS

ALA4635995

Name:
(3S,8S,9R,10R,11R,13R,14S,17R)-4,4,9,13,14-pentamethyl-17-[(1R)-1-methyl-4-Show More⌵

Mol. Formula:
C28H49NO2

M.W.:
431.71

1 activity values

1 unique targets

Type:
Unknown

AlogP:
5.56

Polar Surface Area:
52.49

HBA:
3

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.39

DETAILS