Compounds

Type:
---

AlogP:
3.20

Polar Surface Area:
107.44

HBA:
7

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.27

DETAILS

ALA5205876

Name:
(2R,3S,4R,5R,6S)-2-(hydroxymethyl)-6-(6-(4-methoxybenzyl)-2,3-dihydro-1H-inShow More⌵

Mol. Formula:
C23H28O6

M.W.:
400.47

Type:
---

AlogP:
1.29

Polar Surface Area:
99.38

HBA:
6

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.60

DETAILS

ALA5208827

Name:
(2S,3R,4R,5S,6R)-2-(7-chloro-6-(4-methylbenzyl)-2,3-dihydrobenzofuran-4-yl)Show More⌵

Mol. Formula:
C22H25ClO6

M.W.:
420.89

Type:
---

AlogP:
1.69

Polar Surface Area:
99.38

HBA:
6

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.60

DETAILS

ALA5208273

Name:
methyl 2-(((2R,3S,4S,5R,6R)-6-(4-chloro-3-(4-cyclopropylbenzyl)-1H-indol-1-Show More⌵

Mol. Formula:
C26H30ClN3O6

M.W.:
515.99

Type:
---

AlogP:
2.60

Polar Surface Area:
125.21

HBA:
8

HBD:
5

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.31

DETAILS

ALA5182440

Name:
(2R,3R,4S,5S,6R)-2-(4-chloro-3-(4-cyclopropylbenzyl)-1H-indol-1-yl)-6-((metShow More⌵

Mol. Formula:
C25H29ClN2O5

M.W.:
472.97

Type:
---

AlogP:
2.89

Polar Surface Area:
96.11

HBA:
7

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.39

DETAILS

ALA5173206

Name:
6-(4-chloro-3-(4-cyclopropylbenzyl)-1H-indol-1-yl)-3,4,5-trihydroxytetrahydShow More⌵

Mol. Formula:
C25H27ClN2O5

M.W.:
470.95

Type:
---

AlogP:
3.38

Polar Surface Area:
96.44

HBA:
7

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.38

DETAILS

ALA5169703

Name:
N'-(((2R,3S,4S,5R,6R)-6-(4-chloro-3-(4-cyclopropylbenzyl)-1H-indol-1-yl)-3,Show More⌵

Mol. Formula:
C31H30ClN3O5

M.W.:
560.05

Type:
---

AlogP:
4.16

Polar Surface Area:
116.31

HBA:
7

HBD:
4

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.20

DETAILS

ALA4795938

Name:
5-Isopropyl-4-[4-(methylsulfanyl)benzyl]-1H-pyrazol-3-yl beta-D-glucopyranoShow More⌵

Mol. Formula:
C20H28N2O6S

M.W.:
424.52

Type:
Unknown

AlogP:
1.02

Polar Surface Area:
128.06

HBA:
8

HBD:
5

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.42

DETAILS

ALA4793115

Name:
4-Benzyl-5-methyl-1H-pyrazol-3-yl beta-D-glucopyranoside

Mol. Formula:
C17H22N2O6

M.W.:
350.37

Type:
Unknown

AlogP:
-0.51

Polar Surface Area:
128.06

HBA:
7

HBD:
5

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.49

DETAILS

ALA4791676

Name:
5-Methyl-4-(3-phenylpropyl)-1H-pyrazol-3-yl beta-D-glucopyranoside

Mol. Formula:
C19H26N2O6

M.W.:
378.43

Type:
Unknown

AlogP:
0.07

Polar Surface Area:
128.06

HBA:
7

HBD:
5

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.46

DETAILS

ALA4790263

Name:
5-Methyl-4-(2-phenylethyl)-1H-pyrazol-3-yl beta-D-glucopyranoside

Mol. Formula:
C18H24N2O6

M.W.:
364.40

Type:
Unknown

AlogP:
-0.32

Polar Surface Area:
128.06

HBA:
7

HBD:
5

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.48

DETAILS

ALA4787524

Name:
4-(4-Isopropoxybenzyl)-5-methyl-1-propyl-1H-pyrazol-3-yl beta-D-glucopyranoShow More⌵

Mol. Formula:
C23H34N2O7

M.W.:
450.53

Type:
Unknown

AlogP:
1.16

Polar Surface Area:
126.43

HBA:
9

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.45

DETAILS

ALA4786882

Name:
1-Ethyl-4-(4-isopropoxybenzyl)-5-methyl-1H-pyrazol-3-yl beta-D-glucopyranosShow More⌵

Mol. Formula:
C22H32N2O7

M.W.:
436.51

Type:
Unknown

AlogP:
0.77

Polar Surface Area:
126.43

HBA:
9

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.48

DETAILS

ALA4785821

Name:
4-(4-Isopropoxybenzyl)-1,5-dimethyl-1H-pyrazol-3-yl beta-D-glucopyranoside

Mol. Formula:
C21H30N2O7

M.W.:
422.48

Type:
Unknown

AlogP:
0.29

Polar Surface Area:
126.43

HBA:
9

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.50

DETAILS

ALA4765036

Name:
4-(2-Phenylethyl)-1H-indazol-3-yl beta-D-glucopyranoside

Mol. Formula:
C21H24N2O6

M.W.:
400.43

Type:
Unknown

AlogP:
0.53

Polar Surface Area:
128.06

HBA:
7

HBD:
5

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.41

DETAILS

ALA4760667

Name:
4-(4-Isopropoxybenzyl)-1,3-dimethyl-1H-pyrazol-5-yl beta-D-glucopyranoside

Mol. Formula:
C21H30N2O7

M.W.:
422.48

Type:
Unknown

AlogP:
0.29

Polar Surface Area:
126.43

HBA:
9

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.50

DETAILS

ALA4752053

Name:
5-Methyl-4-(3-methylbenzyl)-1H-pyrazol-3-yl beta-D-glucopyranoside

Mol. Formula:
C18H24N2O6

M.W.:
364.40

Type:
Unknown

AlogP:
-0.20

Polar Surface Area:
128.06

HBA:
7

HBD:
5

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.50

DETAILS

ALA4750405

Name:
5-Methyl-4-(2-methylbenzyl)-1H-pyrazol-3-yl beta-D-glucopyranoside

Mol. Formula:
C18H24N2O6

M.W.:
364.40