Compounds

Type:
---

AlogP:
-1.38

Polar Surface Area:
223.11

HBA:
9

HBD:
6

#RO5 Violations:
1

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.24

DETAILS

ALA5197487

Name:
sodium (1-hydroxy-2-(2-(6-oxo-1H-purin-9(6H)-yl)ethoxy)ethyl)phosphonate

Mol. Formula:
C9H11N4Na2O6P

M.W.:
348.16

Type:
---

AlogP:
-1.37

Polar Surface Area:
150.56

HBA:
7

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.38

DETAILS

ALA5207635

Name:
tetrasodium 2-[(2S)-2-[(2-amino-6-oxo-1H-purin-9-yl)methyl]-3-(phosphonatomShow More⌵

Mol. Formula:
C12H17N5Na4O10P2

M.W.:
545.20

Type:
---

AlogP:
-1.40

Polar Surface Area:
232.34

HBA:
10

HBD:
6

#RO5 Violations:
1

#Rotatable Bonds:
12

Passes Ro3:
N

QED Weighted:
0.16

DETAILS

ALA5193549

Name:
sodium (E)-(5-(6-oxo-1H-purin-9(6H)-yl)pent-1-en-1-yl)phosphonate

Mol. Formula:
C10H11N4Na2O4P

M.W.:
328.18

Type:
---

AlogP:
0.59

Polar Surface Area:
121.10

HBA:
5

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.55

DETAILS

ALA5186759

Name:
sodium (2-(2-(2-amino-6-oxo-1H-purin-9(6H)-yl)ethoxy)-1-hydroxyethyl)phosphShow More⌵

Mol. Formula:
C9H12N5Na2O6P

M.W.:
363.18

Type:
---

AlogP:
-1.79

Polar Surface Area:
176.58

HBA:
8

HBD:
5

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.30

DETAILS

ALA5185264

Name:
sodium (1,2-dihydroxy-5-(6-oxo-1H-purin-9(6H)-yl)pentyl)phosphonate

Mol. Formula:
C10H13N4Na2O6P

M.W.:
362.19

Type:
---

AlogP:
-1.24

Polar Surface Area:
161.56

HBA:
7

HBD:
5

#RO5 Violations:
---

#Rotatable Bonds:
6

Passes Ro3:
N

QED Weighted:
0.41

DETAILS

ALA5184028

Name:
tetrasodium 9-[(3R)-4-[(2S)-2-hydroxy-2-phosphonato-ethoxy]-1-(3-phosphonatShow More⌵

Mol. Formula:
C14H17N5Na4O10P2

M.W.:
569.22

Type:
---

AlogP:
-2.05

Polar Surface Area:
228.40

HBA:
9

HBD:
6

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.22

DETAILS

ALA5178774

Name:
tetrasodium 9-[(3R)-4-(2-phosphonatoethoxy)-1-(3-phosphonatopropanoyl)pyrroShow More⌵

Mol. Formula:
C14H17N5Na4O9P2

M.W.:
553.22

Type:
---

AlogP:
-1.37

Polar Surface Area:
208.17

HBA:
8

HBD:
5

#RO5 Violations:
---

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.29

DETAILS

ALA4878296

Name:
3-(2-(4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-7-yl)-4,5-dihydro-1H-imiShow More⌵

Mol. Formula:
C12H16N5O4P

M.W.:
325.27

Type:
Unknown

AlogP:
-0.12

Polar Surface Area:
134.67

HBA:
5

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.57

DETAILS

ALA4873456

Name:
sodium (3-((hypoxanthin-9-yl)methyl)piperidin-1-yl)methylphosphonic acid

Mol. Formula:
C12H16N5Na2O4P

M.W.:
371.25

Type:
Unknown

AlogP:
-0.03

Polar Surface Area:
124.34

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.67

DETAILS

ALA4871215

Name:
sodium (R)-2-(2-((hypoxanthin-9-yl)methyl)pyrrolidin-1-yl)ethyl phosphonic Show More⌵

Mol. Formula:
C12H16N5Na2O4P

M.W.:
371.25

Type:
Unknown

AlogP:
-0.24

Polar Surface Area:
124.34

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.65

DETAILS

ALA4865439

Name:
sodium (R)-2-(2-((guanin-9-yl)methyl)pyrrolidin-1-yl)ethyl phosphonic acid

Mol. Formula:
C12H17N6Na2O4P

M.W.:
386.26

Type:
Unknown

AlogP:
-0.66

Polar Surface Area:
150.36

HBA:
7

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA4864826

Name:
sodium (S)-2-(2-((guanin-9-yl)methyl)pyrrolidin-1-yl)ethyl phosphonic acid

Mol. Formula:
C12H17N6Na2O4P

M.W.:
386.26

Type:
Unknown

AlogP:
-0.66

Polar Surface Area:
150.36

HBA:
7

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA4864370

Name:
sodium (S)-2-(2-((hypoxanthin-9-yl)methyl)pyrrolidin-1-yl)ethyl phosphonic Show More⌵

Mol. Formula:
C12H16N5Na2O4P

M.W.:
371.25

Type:
Unknown

AlogP:
-0.24

Polar Surface Area:
124.34

HBA:
6

HBD:
3

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.65

DETAILS

ALA4857499

Name:
sodium ((2-((hypoxanthin-9-yl)methyl)piperazine-1,4-diyl)bis(ethane-2,1-diyShow More⌵

Mol. Formula:
C14H20N6Na4O7P2

M.W.:
538.26

Type:
Unknown

AlogP:
-1.54

Polar Surface Area:
185.11

HBA:
8

HBD:
5

#RO5 Violations:
---

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.29

DETAILS

ALA4846343

Name:
sodium ((2-((guanin-9-yl)methyl)piperazine-1,4-diyl)bis(ethane-2,1-diyl))biShow More⌵

Mol. Formula:
C14H21N7Na4O7P2

M.W.:
553.27

Type:
Unknown

AlogP:
-1.96

Polar Surface Area:
211.13

HBA:
9

HBD:
6

#RO5 Violations:
1

#Rotatable Bonds:
8

Passes Ro3:
N

QED Weighted:
0.23

DETAILS

ALA4845693

Name:
sodium (3-((guanin-9-yl)methyl)piperidin-1-yl)methyl phosphonic acid

Mol. Formula:
C12H17N6Na2O4P

M.W.:
386.26

Type:
Unknown

AlogP:
-0.45

Polar Surface Area:
150.36

HBA:
7

HBD:
4

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.55

DETAILS

ALA4561412

Name:
(S)-1-(1-(2-amino-6-oxo-1H-purin-9(6H)-yl)-3-hydroxypropan-2-yl)-1H-1,2,3-tShow More⌵

Mol. Formula:
C10H13N8O5P

M.W.:
356.24

Type:
Unknown

AlogP:
-2.67

Polar Surface Area:
198.06

HBA:
10

HBD:
5

#RO5 Violations:
---

#Rotatable Bonds:
5

Passes Ro3:
N

QED Weighted:
0.30

DETAILS

ALA4546337

Name:
(R)-1-(1-(2-amino-6-oxo-1H-purin-9(6H)-yl)-3-hydroxypropan-2-yl)-1H-1,2,3-tShow More⌵

Mol. Formula:
C10H13N8O5P

M.W.:
356.24