Compounds

ALA5272628

Name:
4-((N-(4-(6-Methylbenzo[d]thiazol-2-yl)phenyl)sulfamoyl)methyl)benzoic acid

Mol. Formula:
C22H18N2O4S2

M.W.:
438.53

Type:
---

AlogP:
4.91

Polar Surface Area:
96.36

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.45

DETAILS

ALA5272275

Name:
N-(4-Ethylphenyl)-4-hydroxy-N-isobutyl-2-(tetrahydro-2H-pyran-4-yl)chromaneShow More⌵

Mol. Formula:
C26H35NO5S

M.W.:
473.64

Type:
---

AlogP:
4.71

Polar Surface Area:
76.07

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.63

DETAILS

ALA5272259

Name:
N-(4-Ethylphenyl)-4-hydroxy-N-isobutyl-2-(tetrahydro-2H-pyran-4-yl)quinolinShow More⌵

Mol. Formula:
C26H32N2O4S

M.W.:
468.62

Type:
---

AlogP:
5.25

Polar Surface Area:
79.73

HBA:
5

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.51

DETAILS

ALA5271967

Name:
(2,4-dichloro-3-((1,4-dimethyl-6-(trifluoromethyl)-1H-indol-2-yl)methyl)pheShow More⌵

Mol. Formula:
C26H26Cl2F3N3O2

M.W.:
540.41

Type:
---

AlogP:
5.56

Polar Surface Area:
37.71

HBA:
4

HBD:
---

#RO5 Violations:
2

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.44

DETAILS

ALA5271936

Name:
N-(4-(6-Methylbenzo[d]thiazol-2-yl)phenyl)-3-nitrobenzenesulfonamide

Mol. Formula:
C20H15N3O4S2

M.W.:
425.49

Type:
---

AlogP:
4.98

Polar Surface Area:
102.20

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.36

DETAILS

ALA5271281

Name:
N-Benzyl-N-(4-ethylphenyl)-4-hydroxy-2-(tetrahydro-2H-pyran-4-yl)chromane-6Show More⌵

Mol. Formula:
C29H33NO5S

M.W.:
507.65

Type:
---

AlogP:
5.26

Polar Surface Area:
76.07

HBA:
5

HBD:
1

#RO5 Violations:
2

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.47

DETAILS

ALA5271159

Name:
2-(4-(Ethylsulfonyl)phenyl)-N-(4-(6-methylbenzo[d]thiazol-2-yl)phenyl)acetaShow More⌵

Mol. Formula:
C24H22N2O3S2

M.W.:
450.59

Type:
---

AlogP:
5.25

Polar Surface Area:
76.13

HBA:
5

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.44

DETAILS

ALA5271074

Name:
N-(4-(6-Methylbenzo[d]thiazol-2-yl)phenyl)-1-(2-nitrophenyl)methanesulfonamShow More⌵

Mol. Formula:
C21H17N3O4S2

M.W.:
439.52

Type:
---

AlogP:
5.12

Polar Surface Area:
102.20

HBA:
6

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.33

DETAILS

ALA5270926

Name:
N-(4-Ethylphenyl)-1-hydroxy-N-isobutyl-7-((tetrahydro-2H-pyran-4-yl)methoxyShow More⌵

Mol. Formula:
C27H37NO5S

M.W.:
487.66

Type:
---

AlogP:
4.89

Polar Surface Area:
76.07

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.55

DETAILS

ALA5270867

Name:
N-(4-Ethylphenyl)-4-hydroxy-N-(oxetan-3-yl)-2-(tetrahydro-2H-pyran-4-yl)chrShow More⌵

Mol. Formula:
C25H31NO6S

M.W.:
473.59

Type:
---

AlogP:
3.45

Polar Surface Area:
85.30

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.69

DETAILS

ALA5270756

Name:
(5S,8S)-3-(2,6-difluorophenyl)-9,9-dimethyl-8-(2-(piperidin-1-yl)pyrimidin-Show More⌵

Mol. Formula:
C26H27F2N5

M.W.:
447.53

Type:
---

AlogP:
5.41

Polar Surface Area:
54.80

HBA:
5

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.54

DETAILS

ALA5270647

Name:
(6aR,7R,10aS)-7,10a-dimethyl-2-(3-methylpyridin-4-yl)-8-oxo-4-phenyl-5,6,6aShow More⌵

Mol. Formula:
C27H24N4O

M.W.:
420.52

Type:
---

AlogP:
5.00

Polar Surface Area:
79.53

HBA:
5

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.58

DETAILS

ALA5270326

Name:
N-(2-(2-(2,4-difluorophenoxy)propan-2-yl)-1-ethyl-1H-benzo[d]imidazol-5-yl)Show More⌵

Mol. Formula:
C28H29F2N3O4S

M.W.:
541.62

Type:
---

AlogP:
5.62

Polar Surface Area:
90.29

HBA:
6

HBD:
1

#RO5 Violations:
2

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.30

DETAILS

ALA5270164

Name:
(R)-2-(4-(2-(4-(Ethylsulfonyl)phenyl)acetamido)phenyl)-N-isopropyl-1-(1-(p-Show More⌵

Mol. Formula:
C36H38N4O4S

M.W.:
622.79

Type:
---

AlogP:
6.73

Polar Surface Area:
110.16

HBA:
6

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.18

DETAILS

ALA5269692

Name:
N-(4-Cyanophenyl)-4-hydroxy-N-isobutyl-2-(tetrahydro-2H-pyran-4-yl)chromaneShow More⌵

Mol. Formula:
C25H30N2O5S

M.W.:
470.59

Type:
---

AlogP:
4.02

Polar Surface Area:
99.86

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.68

DETAILS

ALA5268986

Name:
2-(4-((4'-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-[1,1'-biphenyl]-4-yShow More⌵

Mol. Formula:
C28H27F6N3O3

M.W.:
567.53

Type:
---

AlogP:
5.22

Polar Surface Area:
76.90

HBA:
5

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.36

DETAILS

ALA5268903

Name:
4-(Cyclohexyloxy)-N-(4-ethylphenyl)-N-isobutyl-2-(tetrahydro-2H-pyran-4-yl)Show More⌵

Mol. Formula:
C32H45NO5S

M.W.:
555.78

Type:
---

AlogP:
7.07

Polar Surface Area:
65.07

HBA:
5

HBD:
---

#RO5 Violations:
2

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.33

DETAILS

ALA5268772

Name:
N-(4-(6-methylbenzo[d]thiazol-2-yl)phenyl)-1-(4-nitrophenyl)methanesulfonamShow More⌵

Mol. Formula:
C21H17N3O4S2

M.W.:
439.52

Type:
---

AlogP:
5.12

Polar Surface Area:
102.20

HBA:
6

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.33

DETAILS

ALA5268552

Name:
N-Cyclobutyl-N-(2,4-dimethylphenyl)-4-hydroxy-2-(tetrahydro-2H-pyran-4-yl)cShow More⌵

Mol. Formula:
C26H33NO5S

M.W.:
471.62

Type:
---

AlogP:
4.66

Polar Surface Area:
76.07

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.69

DETAILS

ALA5268449

Name:
4-Amino-N-(4-ethylphenyl)-N-isobutyl-2-(tetrahydro-2H-pyran-4-yl)chromane-6Show More⌵

Mol. Formula:
C26H36N2O4S

M.W.:
472.65

Type:
---

AlogP:
4.68

Polar Surface Area:
81.86

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.63

DETAILS