Compounds

Type:
---

AlogP:
5.24

Polar Surface Area:
104.96

HBA:
8

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.30

DETAILS

ALA5201618

Name:
(E)-N-(1-(4-((3-hydroxybenzyl)amino)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-Show More⌵

Mol. Formula:
C33H31N5O3

M.W.:
545.64

Type:
---

AlogP:
6.20

Polar Surface Area:
101.30

HBA:
7

HBD:
3

#RO5 Violations:
2

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.20

DETAILS

ALA5207852

Name:
1-(4-((3-aminobenzyl)amino)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)-2-mShow More⌵

Mol. Formula:
C24H24N6O

M.W.:
412.50

Type:
---

AlogP:
3.51

Polar Surface Area:
111.85

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.43

DETAILS

ALA5206855

Name:
4-(4-((2-(cyclopentylthio)-1-(pyridin-3-yl)-1H-imidazol-5-yl)methoxy)-2-metShow More⌵

Mol. Formula:
C28H34N4OS

M.W.:
474.67

Type:
---

AlogP:
5.93

Polar Surface Area:
51.97

HBA:
6

HBD:
1

#RO5 Violations:
1

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.31

DETAILS

ALA5190425

Name:
(3-(((2-(4-(methoxy(methyl)carbamoyl)-2-methyl-1H-indol-1-yl)-6,7-dihydro-5Show More⌵

Mol. Formula:
C26H28BN5O4

M.W.:
485.35

Type:
---

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA5182517

Name:
1-(4-((3-hydroxybenzyl)amino)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)-NShow More⌵

Mol. Formula:
C26H27N5O3

M.W.:
457.53

Type:
---

AlogP:
4.17

Polar Surface Area:
92.51

HBA:
7

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.42

DETAILS

ALA5182335

Name:
N-(1-(4-((3-hydroxybenzyl)amino)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-ylShow More⌵

Mol. Formula:
C32H29N5O2

M.W.:
515.62

Type:
---

AlogP:
6.19

Polar Surface Area:
92.07

HBA:
6

HBD:
3

#RO5 Violations:
2

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.22

DETAILS

ALA5174989

Name:
N-(1-(4-((3-hydroxybenzyl)amino)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-ylShow More⌵

Mol. Formula:
C28H25N5O2S

M.W.:
495.61

Type:
---

AlogP:
5.85

Polar Surface Area:
92.07

HBA:
7

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.27

DETAILS

ALA5169705

Name:
1-(4-((3-hydroxybenzyl)amino)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)-2Show More⌵

Mol. Formula:
C24H24N6O

M.W.:
412.50

Type:
---

AlogP:
3.82

Polar Surface Area:
112.84

HBA:
6

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.29

DETAILS

ALA4878519

Name:
(E)-3-((2-(4-but-2-enamido-2-methyl-1H-indol-1-yl)-6,7-dihydro-5H-cyclopentShow More⌵

Mol. Formula:
C27H28BN5O3

M.W.:
481.37

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA4877750

Name:
3-((2-(4-(isoxazole-5-carboxamido)-2-methyl-1H-indol-1-yl)-6,7-dihydro-5H-cShow More⌵

Mol. Formula:
C27H25BN6O4

M.W.:
508.35

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA4877447

Name:
3-((2-(4-but-2-ynamido-2-methyl-1H-indol-1-yl)-7,8-dihydro-5H-pyrano[4,3-d]Show More⌵

Mol. Formula:
C27H26BN5O4

M.W.:
495.35

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA4876550

Name:
3-((2-(2-methyl-4-(methylsulfonamido)-1H-indol-1-yl)quinazolin-4-ylamino)meShow More⌵

Mol. Formula:
C25H24BN5O4S

M.W.:
501.38

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA4872975

Name:
3-((2-(4-but-2-ynamido-2-methyl-1H-indol-1-yl)-5,6,7,8-tetrahydroquinazolinShow More⌵

Mol. Formula:
C28H28BN5O3

M.W.:
493.38

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA4871978

Name:
3-((2-(2-methyl-4-(methylsulfonamido)-1H-indol-1-yl)-6,7-dihydro-5H-cyclopeShow More⌵

Mol. Formula:
C24H26BN5O4S

M.W.:
491.38

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA4871208

Name:
3-((2-(4-(furan-2-carboxamido)-2-methyl-1H-indol-1-yl)-7,8-dihydro-5H-pyranShow More⌵

Mol. Formula:
C28H26BN5O5

M.W.:
523.36

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA4870059

Name:
3-((2-(2-methyl-4-(thiazole-4-carboxamido)-1H-indol-1-yl)-6,7-dihydro-5H-cyShow More⌵

Mol. Formula:
C27H25BN6O3S

M.W.:
524.42

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA4864700

Name:
3-((2-(4-but-2-ynamido-2-methyl-1H-indol-1-yl)quinazolin-4-ylamino)methyl)pShow More⌵

Mol. Formula:
C28H24BN5O3

M.W.:
489.34

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA4862740

Name:
3-((2-(2-methyl-4-(methylsulfonamido)-1H-indol-1-yl)-5,6,7,8-tetrahydroquinShow More⌵

Mol. Formula:
C25H28BN5O4S

M.W.:
505.41

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA4861682

Name:
3-((2-(4-(2-cyanoacetamido)-2-methyl-1H-indol-1-yl)-6,7-dihydro-5H-cyclopenShow More⌵

Mol. Formula:
C26H25BN6O3

M.W.:
480.34