Compounds

ALA4299208

Name:
tetraammonium 2-amino-9-[(2R,3R,4S,5R)-5-({[(S)-({[({[(R)-{[(2R,3S,4R,5R)-5Show More⌵

Mol. Formula:
C22H46B2N14O19P4

M.W.:
956.21

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA4299207

Name:
tetraammonium 2-amino-9-[(2R,3R,4S,5R)-5-({[(S)-({[({[(R)-{[(2R,3S,4R,5R)-5Show More⌵

Mol. Formula:
C23H48B2N14O18P4

M.W.:
954.24

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA4299206

Name:
tetraammonium 2-amino-9-[(2R,3R,4S,5R)-5-({[(S)-({[({[(S)-{[(2R,3S,4R,5R)-5Show More⌵

Mol. Formula:
C22H46B2N14O19P4

M.W.:
956.21

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA4299194

Name:
tetraammonium 2-amino-9-[(2R,3R,4S,5R)-5-({[(S)-({[({[(S)-{[(2R,3S,4R,5R)-5Show More⌵

Mol. Formula:
C23H48B2N14O18P4

M.W.:
954.24

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA4299192

Name:
tetraammonium 2-amino-9-[(2R,3R,4S,5R)-5-({[(R)-({[({[(R)-{[(2R,3S,4R,5R)-5Show More⌵

Mol. Formula:
C23H48B2N14O18P4

M.W.:
954.24

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA3604559

Name:
2-amino-9-((2R,3R,4S,5R)-5-(((((((((2R,3S,4R,5R)-5-(2-amino-6-oxo-1H-purin-Show More⌵

Mol. Formula:
C22H32N10O20P4

M.W.:
880.44

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
-4.54

Polar Surface Area:
458.76

HBA:
24

HBD:
11

#RO5 Violations:
3

#Rotatable Bonds:
14

Passes Ro3:
N

QED Weighted:
0.04

DETAILS

ALA3604558

Name:
2-amino-9-[(2R,3R,4S,5R)-5-({[({[({[(2R,3S,4R,5R)-5-(2-amino-7-methyl-6-oxiShow More⌵

Mol. Formula:
C22H32BN10O17P3

M.W.:
812.29

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA3604557

Name:
2-amino-9-[(2R,3R,4S,5R)-5-[[[[[[(2R,3S,4R,5R)-5-(2-amino-7-methyl-6-oxido-Show More⌵

Mol. Formula:
C22H32N10O21P4

M.W.:
896.44

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
-5.44

Polar Surface Area:
462.07

HBA:
25

HBD:
10

#RO5 Violations:
3

#Rotatable Bonds:
14

Passes Ro3:
N

QED Weighted:
0.04

DETAILS

ALA3604556

Name:
2-amino-9-[(2R,3R,4S,5R)-5-[[[[[(2R,3S,4R,5R)-5-(2-amino-7-methyl-6-oxido-pShow More⌵

Mol. Formula:
C22H31N10O18P3

M.W.:
816.46

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
-5.56

Polar Surface Area:
415.54

HBA:
23

HBD:
9

#RO5 Violations:
3

#Rotatable Bonds:
12

Passes Ro3:
N

QED Weighted:
0.05

DETAILS

ALA3604548

Name:
tetraammonium 2-amino-9-[(2R,3R,4S,5R)-5-({[(R)-({[({[(R)-{[(2R,3S,4R,5R)-5Show More⌵

Mol. Formula:
C23H46N14O18P4S2

M.W.:
994.73

Type:
Small molecule

AlogP:
-3.45

Polar Surface Area:
412.38

HBA:
26

HBD:
10

#RO5 Violations:
3

#Rotatable Bonds:
14

Passes Ro3:
N

QED Weighted:
0.03

DETAILS

ALA3604547

Name:
tetraammonium 2-amino-9-[(2R,3R,4S,5R)-5-({[(S)-({[({[(R)-{[(2R,3S,4R,5R)-5Show More⌵

Mol. Formula:
C23H46N14O18P4S2

M.W.:
994.73

Type:
Small molecule

AlogP:
-3.45

Polar Surface Area:
412.38

HBA:
26

HBD:
10

#RO5 Violations:
3

#Rotatable Bonds:
14

Passes Ro3:
N

QED Weighted:
0.03

DETAILS

ALA3604546

Name:
tetraammonium 2-amino-9-[(2R,3R,4S,5R)-5-({[(S)-({[({[(S)-{[(2R,3S,4R,5R)-5Show More⌵

Mol. Formula:
C23H46N14O18P4S2

M.W.:
994.73

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
-3.45

Polar Surface Area:
412.38

HBA:
26

HBD:
10

#RO5 Violations:
3

#Rotatable Bonds:
14

Passes Ro3:
N

QED Weighted:
0.03

DETAILS

ALA3604545

Name:
tetraammonium 2-amino-9-[(2R,3R,4S,5R)-5-({[(R)-({[({[(R)-{[(2R,3S,4R,5R)-5Show More⌵

Mol. Formula:
C22H44N14O19P4S2

M.W.:
996.70

Type:
Small molecule

AlogP:
-3.57

Polar Surface Area:
421.61

HBA:
27

HBD:
10

#RO5 Violations:
3

#Rotatable Bonds:
14

Passes Ro3:
N

QED Weighted:
0.03

DETAILS

ALA3604544

Name:
tetraammonium 2-amino-9-[(2R,3R,4S,5R)-5-{[({[({[({[(2R,3S,4R,5R)-5-(2-aminShow More⌵

Mol. Formula:
C22H44N14O19P4S2

M.W.:
996.70

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
-3.57

Polar Surface Area:
421.61

HBA:
27

HBD:
10

#RO5 Violations:
3

#Rotatable Bonds:
14

Passes Ro3:
N

QED Weighted:
0.03

DETAILS

ALA3350635

Name:
m2(7,2'-O)GpCH2pppG

Mol. Formula:
C23H34N10O20P4

M.W.:
894.47

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
-3.88

Polar Surface Area:
447.76

HBA:
25

HBD:
10

#RO5 Violations:
3

#Rotatable Bonds:
15

Passes Ro3:
N

QED Weighted:
0.04

DETAILS

ALA3350634

Name:
m2(7,2'-O)GpppCH2pG

Mol. Formula:
C23H34N10O20P4

M.W.:
894.47

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
-3.88

Polar Surface Area:
447.76

HBA:
25

HBD:
10

#RO5 Violations:
3

#Rotatable Bonds:
15

Passes Ro3:
N

QED Weighted:
0.04

DETAILS

ALA3350633

Name:
m2(7,2'-O)GpCH2ppG

Mol. Formula:
C23H33N10O17P3

M.W.:
814.49

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
-4.00

Polar Surface Area:
401.23

HBA:
23

HBD:
9

#RO5 Violations:
3

#Rotatable Bonds:
13

Passes Ro3:
N

QED Weighted:
0.05

DETAILS

ALA3350632

Name:
m2(7,2'-O)GppCH2pG

Mol. Formula:
C23H33N10O17P3

M.W.:
814.49

1 activity values

1 unique targets

Type:
Small molecule

AlogP:
-4.00

Polar Surface Area:
401.23

HBA:
23

HBD:
9

#RO5 Violations:
3

#Rotatable Bonds:
13

Passes Ro3:
N

QED Weighted:
0.05

DETAILS

ALA3350631

Name:
m2(7,3'-O)GpppG

Mol. Formula:
C22H31N10O18P3

M.W.:
816.46

5 activity values

4 unique targets

Type:
Small molecule

AlogP:
-4.11

Polar Surface Area:
410.46

HBA:
24

HBD:
9

#RO5 Violations:
3

#Rotatable Bonds:
13

Passes Ro3:
N

QED Weighted:
0.05

DETAILS

ALA3350626

Name:
m(7)GpNHpppG

Mol. Formula:
C21H28N11Na3O20P4

M.W.:
947.38

13 activity values

6 unique targets

Type:
Small molecule

AlogP:
-5.49

Polar Surface Area:
470.53

HBA:
24

HBD:
12

#RO5 Violations:
3

#Rotatable Bonds:
14

Passes Ro3:
N

QED Weighted:
0.04

DETAILS