Compounds

Type:
---

AlogP:
-1.17

Polar Surface Area:
202.02

HBA:
11

HBD:
5

#RO5 Violations:
2

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.23

DETAILS

ALA5186358

Name:
Disodium 5'-O-[1-(phosphonatobenzothiophen-3-ylmethyl)-1,2,3-triazol-4-yl]mShow More⌵

Mol. Formula:
C21H20N5Na2O9PS

M.W.:
595.44

Type:
---

AlogP:
-0.10

Polar Surface Area:
202.02

HBA:
12

HBD:
5

#RO5 Violations:
2

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.18

DETAILS

ALA5185498

Name:
Disodium 5'-O-[1-(phosphonato-3-phenoxy-4-fluorophenylmethyl)-1,2,3-triazolShow More⌵

Mol. Formula:
C25H23FN5Na2O10P

M.W.:
649.44

Type:
---

AlogP:
0.62

Polar Surface Area:
211.25

HBA:
12

HBD:
5

#RO5 Violations:
2

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.16

DETAILS

ALA5180951

Name:
Disodium 5'-O-[1-(phosphonato-3-phenoxyphenylmethyl)-1,2,3-triazol-4-yl]metShow More⌵

Mol. Formula:
C25H24N5Na2O10P

M.W.:
631.45

Type:
---

AlogP:
0.48

Polar Surface Area:
211.25

HBA:
12

HBD:
5

#RO5 Violations:
2

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.16

DETAILS

ALA5177836

Name:
Disodium 5'-O-[1-(phosphonato-3-trifluoromethylphenylmethyl)-1,2,3-triazol-Show More⌵

Mol. Formula:
C20H19F3N5Na2O9P

M.W.:
607.35

Type:
---

AlogP:
-0.29

Polar Surface Area:
202.02

HBA:
11

HBD:
5

#RO5 Violations:
2

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.23

DETAILS

ALA5176503

Name:
Disodium 5'-O-[1-(phosphonato-3-cyclopentoxyphenylmethyl)-1,2,3-triazol-4-yShow More⌵

Mol. Formula:
C24H28N5Na2O10P

M.W.:
623.47

Type:
---

AlogP:
0.01

Polar Surface Area:
211.25

HBA:
12

HBD:
5

#RO5 Violations:
2

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.20

DETAILS

ALA5175639

Name:
Disodium 5'-O-[1-(phosphonato-3-(1,1,2,2-tetrafluoroethoxy)phenylmethyl)-1,Show More⌵

Mol. Formula:
C21H20F4N5Na2O10P

M.W.:
655.36

Type:
---

AlogP:
-0.07

Polar Surface Area:
211.25

HBA:
12

HBD:
5

#RO5 Violations:
2

#Rotatable Bonds:
11

Passes Ro3:
N

QED Weighted:
0.14

DETAILS

ALA5172885

Name:
1-((2R,3R,4S,5R)-3,4-dihydroxy-5-((4-(hydroxy(3-phenoxyphenyl)methyl)-1H-1,Show More⌵

Mol. Formula:
C24H23N5O7

M.W.:
493.48

Type:
---

AlogP:
0.32

Polar Surface Area:
164.72

HBA:
11

HBD:
4

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.28

DETAILS

ALA4795501

Name:
4-[[3-[(S)-[[(2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxytetShow More⌵

Mol. Formula:
C37H27N4Na5O17P2

M.W.:
976.53

1 activity values

Type:
Unknown

AlogP:
2.99

Polar Surface Area:
340.73

HBA:
16

HBD:
9

#RO5 Violations:
3

#Rotatable Bonds:
12

Passes Ro3:
N

QED Weighted:
0.06

DETAILS

ALA4794815

Name:
4-[[3-[(R)-[[(2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxytetShow More⌵

Mol. Formula:
C37H27N4Na5O17P2

M.W.:
976.53

1 activity values

Type:
Unknown

AlogP:
2.99

Polar Surface Area:
340.73

HBA:
16

HBD:
9

#RO5 Violations:
3

#Rotatable Bonds:
12

Passes Ro3:
N

QED Weighted:
0.06

DETAILS

ALA4788959

Name:
Disodium [(3-phenoxy)phenylphosphonatomethyl]-uridin-5'-yl-carbamate

Mol. Formula:
C23H22N3Na2O11P

M.W.:
593.39

Type:
Unknown

AlogP:
0.55

Polar Surface Area:
209.64

HBA:
10

HBD:
6

#RO5 Violations:
2

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.21

DETAILS

ALA4762978

Name:
Disodium [(4-methoxy)phenylphosphonatomethyl]-uridin-5'-yl-carbamate

Mol. Formula:
C18H20N3Na2O11P

M.W.:
531.32

Type:
Unknown

AlogP:
-1.23

Polar Surface Area:
209.64

HBA:
10

HBD:
6

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.25

DETAILS

ALA4762735

Name:
Disodium [(3-methoxy)phenylphosphonatomethyl]-uridin-5'-yl-carbamate

Mol. Formula:
C18H20N3Na2O11P

M.W.:
531.32

Type:
Unknown

AlogP:
-1.23

Polar Surface Area:
209.64

HBA:
10

HBD:
6

#RO5 Violations:
1

#Rotatable Bonds:
7

Passes Ro3:
N

QED Weighted:
0.25

DETAILS

ALA4761148

Name:
Disodium [(3-cyclopentoxy-4-methoxy)phenylphosphonatomethyl]-uridin-5'-yl-cShow More⌵

Mol. Formula:
C23H28N3Na2O12P

M.W.:
615.44

Type:
Unknown

AlogP:
0.09

Polar Surface Area:
218.87

HBA:
11

HBD:
6

#RO5 Violations:
3

#Rotatable Bonds:
9

Passes Ro3:
N

QED Weighted:
0.22

DETAILS

ALA4757654

Name:
Disodium [(3-cyclopentoxy)phenylphosphonatomethyl]-uridin-5'-yl-carbamate

Mol. Formula:
C22H26N3Na2O11P

M.W.:
585.41

Type:
Unknown

AlogP:
0.08

Polar Surface Area:
209.64

HBA:
10

HBD:
6

#RO5 Violations:
2

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.25

DETAILS

ALA4755740

Name:
Disodium [(benzo[b]thiophen-2-yl)phosphonatomethyl]-uridin-5'-ylcarbamate

Mol. Formula:
C19H18N3Na2O10PS

M.W.:
557.39

6 activity values

Type:
Unknown

AlogP:
-0.03

Polar Surface Area:
200.41

HBA:
10

HBD:
6

#RO5 Violations:
2

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.24

DETAILS

ALA4751280

Name:
Disodium [(4-fluoro-3-phenoxy)phenylphosphonatomethyl]-uridin-5'-yl-carbamaShow More⌵

Mol. Formula:
C23H21FN3Na2O11P

M.W.:
611.38

Type:
Unknown

AlogP:
0.69

Polar Surface Area:
209.64

HBA:
10

HBD:
6

#RO5 Violations:
2

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.21

DETAILS

ALA4751271

Name:
Disodium cytidin-5-yl-[(3-phenoxy)phenylphosphonatomethyl]carbamate

Mol. Formula:
C23H23N4Na2O10P

M.W.:
592.41

Type:
Unknown

AlogP:
0.84

Polar Surface Area:
215.69

HBA:
11

HBD:
6

#RO5 Violations:
3

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.22

DETAILS

ALA4751247

Name:
Disodium [(3-fluoro)phenylphosphonatomethyl]-uridin-5'-yl-carbamate

Mol. Formula:
C17H17FN3Na2O10P

M.W.:
519.29

6 activity values

Type:
Unknown

AlogP:
-1.10

Polar Surface Area:
200.41

HBA:
9

HBD:
6

#RO5 Violations:
1

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.28

DETAILS

ALA4751022

Name:
Disodium [phenylphosphonatomethyl]-uridin-5'-yl-carbamate

Mol. Formula:
C17H18N3Na2O10P

M.W.:
501.30