Compounds

ALA3087166

Name:
((R)-(((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuranShow More⌵

Mol. Formula:
C11H17BCl2N5O11P3

M.W.:
569.92

6 activity values

4 unique targets

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA3087165

Name:
((S)-(((2R,3S,4R,5R)-5-(6-amino-2-(methylthio)-9H-purin-9-yl)-3,4-dihydroxyShow More⌵

Mol. Formula:
C12H19BF2N5O11P3S

M.W.:
583.11

5 activity values

4 unique targets

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA3087164

Name:
((R)-(((2R,3S,4R,5R)-5-(6-amino-2-(methylthio)-9H-purin-9-yl)-3,4-dihydroxyShow More⌵

Mol. Formula:
C12H19BF2N5O11P3S

M.W.:
583.11

5 activity values

5 unique targets

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA3087161

Name:
((R)-(((2R,3S,4R,5R)-5-(6-amino-2-(methylthio)-9H-purin-9-yl)-3,4-dihydroxyShow More⌵

Mol. Formula:
C12H21BN5O11P3S

M.W.:
547.13

5 activity values

5 unique targets

Type:
Unknown

AlogP:
---

Polar Surface Area:
---

HBA:
---

HBD:
---

#RO5 Violations:
na

#Rotatable Bonds:
---

Passes Ro3:
---

QED Weighted:
---

DETAILS

ALA515169

Name:
4-[(2S,3R,4S,5R)-5-(6-Amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofurane-2-Show More⌵

Mol. Formula:
C19H30N7O8P

M.W.:
515.46

7 activity values

7 unique targets

Type:
Small molecule

AlogP:
-0.74

Polar Surface Area:
213.04

HBA:
13

HBD:
5

#RO5 Violations:
2

#Rotatable Bonds:
12

Passes Ro3:
N

QED Weighted:
0.17

DETAILS

ALA467388

Name:
3-[(2S,3R,4S,5R)-5-(6-Amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofurane-2-Show More⌵

Mol. Formula:
C18H28N7O8P

M.W.:
501.44

7 activity values

7 unique targets

Type:
Small molecule

AlogP:
-1.13

Polar Surface Area:
213.04

HBA:
13

HBD:
5

#RO5 Violations:
2

#Rotatable Bonds:
11

Passes Ro3:
N

QED Weighted:
0.23

DETAILS

ALA464548

Name:
4-[4-((2S,3R,4S,5R)-5-(6-Amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuraneShow More⌵

Mol. Formula:
C25H34N7O8P

M.W.:
591.56

7 activity values

7 unique targets

Type:
Small molecule

AlogP:
1.33

Polar Surface Area:
213.04

HBA:
13

HBD:
5

#RO5 Violations:
2

#Rotatable Bonds:
13

Passes Ro3:
N

QED Weighted:
0.14

DETAILS

ALA511933

Name:
4-[3-((2S,3R,4S,5R)-5-(2,4-Dioxo-3,4-dihydropyrimidin-1(2H)-yl)-3,4-dihydroShow More⌵

Mol. Formula:
C23H31N4O10P

M.W.:
554.49

13 activity values

9 unique targets

Type:
Small molecule

AlogP:
0.07

Polar Surface Area:
198.28

HBA:
11

HBD:
5

#RO5 Violations:
2

#Rotatable Bonds:
12

Passes Ro3:
N

QED Weighted:
0.22

DETAILS

PSB-6426

Name:
4-[2-((2S,3R,4S,5R)-5-(2,4-Dioxo-3,4-dihydropyrimidin-1(2H)-yl)-3,4-dihydroShow More⌵

Mol. Formula:
C22H29N4O10P

M.W.:
540.47

14 activity values

9 unique targets

Type:
Small molecule

AlogP:
-0.32

Polar Surface Area:
198.28

HBA:
11

HBD:
5

#RO5 Violations:
2

#Rotatable Bonds:
11

Passes Ro3:
N

QED Weighted:
0.24

DETAILS