Compounds

Type:
Unknown

AlogP:
6.39

Polar Surface Area:
206.51

HBA:
13

HBD:
3

#RO5 Violations:
3

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.15

DETAILS

ALA4580738

Name:
NA

Mol. Formula:
C55H89N2O14PS

M.W.:
1065.36

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA4563398

Name:
NA

Mol. Formula:
C55H87N3O13

M.W.:
998.31

Type:
Unknown

AlogP:
6.09

Polar Surface Area:
212.91

HBA:
13

HBD:
4

#RO5 Violations:
3

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.12

DETAILS

ALA4529771

Name:
NA

Mol. Formula:
C52H82N2O13S

M.W.:
975.30

Type:
Unknown

AlogP:
6.00

Polar Surface Area:
206.51

HBA:
13

HBD:
3

#RO5 Violations:
3

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.16

DETAILS

ALA4465976

Name:
NA

Mol. Formula:
C53H82N6O12S

M.W.:
1027.34

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA1765713

Name:
1-(4-fluoro-2-(trifluoromethyl)phenyl)-9-(1-methyl-1H-pyrazol-4-yl)benzo[h]Show More⌵

Mol. Formula:
C23H14F4N4O

M.W.:
438.38

Type:
Small molecule

AlogP:
5.10

Polar Surface Area:
52.71

HBA:
5

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.28

DETAILS

ALA1765616

Name:
1-(3-chloro-4-fluorophenyl)-9-(quinolin-3-yl)benzo[h][1,6]naphthyridin-2(1HShow More⌵

Mol. Formula:
C27H15ClFN3O

M.W.:
451.89

Type:
Small molecule

AlogP:
6.55

Polar Surface Area:
47.78

HBA:
4

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.28

DETAILS

ALA1765614

Name:
9-(2-aminopyrimidin-5-yl)-1-(4-fluoro-3-methylphenyl)benzo[h][1,6]naphthyriShow More⌵

Mol. Formula:
C23H16FN5O

M.W.:
397.41

Type:
Small molecule

AlogP:
4.03

Polar Surface Area:
86.69

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.45

DETAILS

ALA1765612

Name:
1-(4-fluoro-3-methylphenyl)-9-(6-methoxypyridin-3-yl)benzo[h][1,6]naphthyriShow More⌵

Mol. Formula:
C25H18FN3O2

M.W.:
411.44

Type:
Small molecule

AlogP:
5.06

Polar Surface Area:
57.01

HBA:
5

HBD:
---

#RO5 Violations:
1

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.39

DETAILS

ALA1765607

Name:
1-(4-fluoro-3-(trifluoromethyl)phenyl)-9-(1H-indazol-5-yl)benzo[h][1,6]naphShow More⌵

Mol. Formula:
C26H14F4N4O

M.W.:
474.42

Type:
Small molecule

AlogP:
6.24

Polar Surface Area:
63.57

HBA:
4

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.24

DETAILS

ALA1765606

Name:
9-(2-aminopyrimidin-5-yl)-1-(4-fluoro-3-(trifluoromethyl)phenyl)benzo[h][1,Show More⌵

Mol. Formula:
C23H13F4N5O

M.W.:
451.38

Type:
Small molecule

AlogP:
4.74

Polar Surface Area:
86.69

HBA:
6

HBD:
1

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.31

DETAILS

QL-IX-55

Name:
9-(6-aminopyridin-3-yl)-1-(4-fluoro-3-(trifluoromethyl)phenyl)benzo[h][1,6]Show More⌵

Mol. Formula:
C24H14F4N4O

M.W.:
450.40

Type:
Small molecule

AlogP:
5.34

Polar Surface Area:
73.80

HBA:
5

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.29

DETAILS

ALA1765604

Name:
1-(4-fluoro-3-(trifluoromethyl)phenyl)-9-(1-methyl-1H-pyrazol-4-yl)benzo[h]Show More⌵

Mol. Formula:
C23H14F4N4O

M.W.:
438.38