Compounds

ALA5272457

Name:
N-(4-(4-Chlorophenoxy)-3-(3-methyl-2-oxo-1,2-dihydroquinoxalin-6-yl)phenyl)Show More⌵

Mol. Formula:
C22H18ClN3O4S

M.W.:
455.92

Type:
---

AlogP:
4.72

Polar Surface Area:
101.15

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.45

DETAILS

ALA5272408

Name:
N-(3-fluorophenyl)-2-(3-methyl-1H-indazol-5-yl)-6-(4-methylpiperazin-1-yl)iShow More⌵

Mol. Formula:
C25H25FN8

M.W.:
456.53

Type:
---

AlogP:
4.22

Polar Surface Area:
77.38

HBA:
7

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.42

DETAILS

ALA5272284

Name:
N-(4-iodophenyl)-2-(3-methyl-1H-indazol-5-yl)-6-(4-methylpiperazin-1-yl)imiShow More⌵

Mol. Formula:
C25H25IN8

M.W.:
564.44

Type:
---

AlogP:
4.68

Polar Surface Area:
77.38

HBA:
7

HBD:
2

#RO5 Violations:
1

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.31

DETAILS

ALA5272010

Name:

Mol. Formula:
C56H57ClN6O9S

M.W.:
1025.62

Type:
---

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA5271988

Name:
6-(4-chlorophenyl)-7-methoxy-1-methyl-4H-isoxazolo[5,4-c]pyrido[4,3-e]azepiShow More⌵

Mol. Formula:
C18H14ClN3O2

M.W.:
339.78

Type:
---

AlogP:
4.06

Polar Surface Area:
60.51

HBA:
5

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.71

DETAILS

ALA5271781

Name:
6-(4-chlorophenyl)-1-methyl-4H-benzo[c]isoxazolo[4,3-e]azepine

Mol. Formula:
C18H13ClN2O

M.W.:
308.77

Type:
---

AlogP:
4.65

Polar Surface Area:
38.39

HBA:
3

HBD:
---

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.66

DETAILS

ALA5271254

Name:
N-(2,5-dimethylphenyl)-2-(3-methyl-1H-indazol-5-yl)-6-(4-methylpiperazin-1-Show More⌵

Mol. Formula:
C27H30N8

M.W.:
466.59

Type:
---

AlogP:
4.69

Polar Surface Area:
77.38

HBA:
7

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.40

DETAILS

ALA5271011

Name:
N-(4-(2,4-Difluorophenoxy)-3-(3,7-dimethyl-2-oxo-1,2,3,4-tetrahydroquinoxalShow More⌵

Mol. Formula:
C23H21F2N3O4S

M.W.:
473.50

Type:
---

AlogP:
4.86

Polar Surface Area:
96.53

HBA:
5

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.49

DETAILS

ALA5270976

Name:
N-(4-(2-Methoxyphenoxy)-3-(3-methyl-2-oxo-1,2-dihydroquinoxalin-6-yl)phenylShow More⌵

Mol. Formula:
C23H21N3O5S

M.W.:
451.50

Type:
---

AlogP:
4.07

Polar Surface Area:
110.38

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.46

DETAILS

ALA5270932

Name:
(S)-2-chloro-N-(4-(2-((2-(2-(2-(4-(4-chlorophenyl)-2,3,9-trimethyl-6H-thienShow More⌵

Mol. Formula:
C38H41Cl2N9O5S

M.W.:
806.78

Type:
---

AlogP:
4.82

Polar Surface Area:
167.07

HBA:
12

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
15

Passes Ro3:
N

QED Weighted:
0.13

DETAILS

ALA5270270

Name:
N-(2-(2-fluorophenoxy)ethyl)-6,7-dimethoxyquinazolin-4-amine

Mol. Formula:
C18H18FN3O3

M.W.:
343.36

Type:
---

AlogP:
3.28

Polar Surface Area:
65.50

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.66

DETAILS

ALA5270020

Name:
2-((S)-4-(4-chlorophenyl)-2,3,9-trimethyl-6H-thieno[3,2-f][1,2,4]triazolo[4Show More⌵

Mol. Formula:
C37H39ClN8O4S

M.W.:
727.29

Type:
---

AlogP:
5.35

Polar Surface Area:
150.68

HBA:
10

HBD:
3

#RO5 Violations:
2

#Rotatable Bonds:
11

Passes Ro3:
N

QED Weighted:
0.14

DETAILS

ALA5269983

Name:
methyl 4-(((2S,4R)-6-(3-acetamidophenyl)-1-acetyl-2-methyl-1,2,3,4-tetrahydShow More⌵

Mol. Formula:
C28H29N3O4

M.W.:
471.56

Type:
---

AlogP:
5.40

Polar Surface Area:
87.74

HBA:
5

HBD:
2

#RO5 Violations:
1

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.49

DETAILS

ALA5269731

Name:
N-(4-(2,4-Difluorophenoxy)-3-(3-methyl-2-oxo-1,2-dihydroquinoxalin-6-yl)pheShow More⌵

Mol. Formula:
C22H17F2N3O4S

M.W.:
457.46

Type:
---

AlogP:
4.34

Polar Surface Area:
101.15

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.46

DETAILS

ALA5269534

Name:
6-(2-(2,4-Difluorophenoxy)-5-(methylsulfonyl)phenyl)-3-methylquinoxalin-2(1Show More⌵

Mol. Formula:
C22H16F2N2O4S

M.W.:
442.44

Type:
---

AlogP:
4.37

Polar Surface Area:
89.12

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.51

DETAILS

ALA5269306

Name:
6-(4-chlorophenyl)-1-methyl-4H-isoxazolo[5,4-c]pyrido[4,3-e]azepin-7-amine

Mol. Formula:
C17H13ClN4O

M.W.:
324.77

Type:
---

AlogP:
3.63

Polar Surface Area:
77.30

HBA:
5

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
1

Passes Ro3:
N

QED Weighted:
0.74

DETAILS

ALA5269292

Name:
4-(2,4-Difluorophenoxy)-3-(3-methyl-2-oxo-1,2-dihydroquinoxalin-6-yl)benzalShow More⌵

Mol. Formula:
C22H14F2N2O3

M.W.:
392.36

Type:
---

AlogP:
4.78

Polar Surface Area:
72.05

HBA:
4

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.51

DETAILS

ALA5269273

Name:
N-(4-fluorophenyl)-2-(3-methyl-1H-indazol-5-yl)-6-(4-methylpiperazin-1-yl)iShow More⌵

Mol. Formula:
C25H25FN8

M.W.:
456.53

Type:
---

AlogP:
4.22

Polar Surface Area:
77.38

HBA:
7

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.42

DETAILS

ALA5268242

Name:
N-(4-bromo-2-chlorophenyl)-2-(3-methyl-1H-indazol-5-yl)-6-(4-methylpiperaziShow More⌵

Mol. Formula:
C25H24BrClN8

M.W.:
551.88

Type:
---

AlogP:
5.49

Polar Surface Area:
77.38

HBA:
7

HBD:
2

#RO5 Violations:
2

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.31

DETAILS

ALA5267895

Name:
(4-(2-Chloro-4-fluorophenoxy)-3-(3-methyl-2-oxo-1,2-dihydroquinoxalin-6-yl)Show More⌵

Mol. Formula:
C22H17ClFN3O4S

M.W.:
473.91

Type:
---

AlogP:
4.85

Polar Surface Area:
101.15

HBA:
5

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.43

DETAILS