Compounds

ALA5271779

Name:
Isopropyl ((S)-(1(4R,5R)-5-(4-Amino-2-oxopyrimidin-1(2H)-yl)-4-hydroxy-4,5-Show More⌵

Mol. Formula:
C21H27N4O8P

M.W.:
494.44

Type:
---

AlogP:
1.73

Polar Surface Area:
164.23

HBA:
11

HBD:
3

#RO5 Violations:
1

#Rotatable Bonds:
10

Passes Ro3:
N

QED Weighted:
0.33

DETAILS

ALA5271518

Name:
(2R,3R,4R,5R)-4-fluoro-2-(hydroxymethyl)-5-(5-((3-methoxyphenyl)ethynyl)-4-Show More⌵

Mol. Formula:
C22H22FN3O4

M.W.:
411.43

Type:
---

AlogP:
2.13

Polar Surface Area:
89.63

HBA:
7

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.64

DETAILS

ALA5268578

Name:
(2R,3R,4R,5R)-4-fluoro-2-(hydroxymethyl)-4-methyl-5-(4-methyl-5-(4-phenyl-1Show More⌵

Mol. Formula:
C21H21FN6O3

M.W.:
424.44

Type:
---

AlogP:
1.97

Polar Surface Area:
111.11

HBA:
9

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.52

DETAILS

ALA5267997

Name:
(2R,3R,4R,5R)-4-fluoro-5-(5-((4-fluorophenyl)ethynyl)-4-methyl-7H-pyrrolo[2Show More⌵

Mol. Formula:
C21H19F2N3O3

M.W.:
399.40

Type:
---

AlogP:
2.26

Polar Surface Area:
80.40

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.65

DETAILS

ALA5267777

Name:
(2R,3R,4R,5R)-5-(5-(cyclopropylethynyl)-4-methyl-7H-pyrrolo[2,3-d]pyrimidinShow More⌵

Mol. Formula:
C18H20FN3O3

M.W.:
345.37

Type:
---

AlogP:
1.48

Polar Surface Area:
80.40

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.81

DETAILS

ALA5282223

Name:
(2R,3R,4R,5R)-4-fluoro-2-(hydroxymethyl)-4-methyl-5-(4-methyl-5-(p-tolylethShow More⌵

Mol. Formula:
C22H22FN3O3

M.W.:
395.43

Type:
---

AlogP:
2.43

Polar Surface Area:
80.40

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.65

DETAILS

ALA5281877

Name:
(2R,3R,4R,5R)-4-fluoro-2-(hydroxymethyl)-4-methyl-5-(4-methyl-5-(pyrimidin-Show More⌵

Mol. Formula:
C19H18FN5O3

M.W.:
383.38

Type:
---

AlogP:
0.91

Polar Surface Area:
106.18

HBA:
8

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.63

DETAILS

ALA5279697

Name:
(2R,3R,4R,5R)-5-(5-ethynyl-4-methyl-7H-pyrrolo[2,3-d]pyrimidin-7-yl)-4-fluoShow More⌵

Mol. Formula:
C15H16FN3O3

M.W.:
305.31

Type:
---

AlogP:
0.70

Polar Surface Area:
80.40

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.80

DETAILS

ALA5279309

Name:
(2R,3R,4R,5R)-4-fluoro-2-(hydroxymethyl)-4-methyl-5-(4-methyl-5-(2-phenylcyShow More⌵

Mol. Formula:
C22H24FN3O3

M.W.:
397.45

Type:
---

AlogP:
2.99

Polar Surface Area:
80.40

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.71

DETAILS

ALA5278801

Name:
(2R,3R,4R,5R)-4-fluoro-2-(hydroxymethyl)-4-methyl-5-(4-methyl-5-(o-tolylethShow More⌵

Mol. Formula:
C22H22FN3O3

M.W.:
395.43

Type:
---

AlogP:
2.43

Polar Surface Area:
80.40

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.65

DETAILS

ALA5276790

Name:
(2R,3R,4R,5R)-4-fluoro-2-(hydroxymethyl)-4-methyl-5-(4-methyl-5-((5-methyltShow More⌵

Mol. Formula:
C20H20FN3O3S

M.W.:
401.46

Type:
---

AlogP:
2.49

Polar Surface Area:
80.40

HBA:
7

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.65

DETAILS

ALA5276299

Name:
(2R,3R,4R,5R)-4-fluoro-2-(hydroxymethyl)-4-methyl-5-(4-methyl-5-phenyl-7H-pShow More⌵

Mol. Formula:
C19H20FN3O3

M.W.:
357.39

Type:
---

AlogP:
2.39

Polar Surface Area:
80.40

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.75

DETAILS

ALA5275928

Name:
(2R,3R,4R,5R)-4-fluoro-2-(hydroxymethyl)-4-methyl-5-(4-methyl-5-(m-tolylethShow More⌵

Mol. Formula:
C22H22FN3O3

M.W.:
395.43

Type:
---

AlogP:
2.43

Polar Surface Area:
80.40

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.65

DETAILS

ALA5275571

Name:
(2R,3R,4R,5R)-4-fluoro-2-(hydroxymethyl)-4-methyl-5-(4-methyl-5-(prop-1-yn-Show More⌵

Mol. Formula:
C16H18FN3O3

M.W.:
319.34

Type:
---

AlogP:
1.09

Polar Surface Area:
80.40

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.81

DETAILS

ALA5274294

Name:
ethyl 5-((7-((2R,3R,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)-3-methyltetShow More⌵

Mol. Formula:
C22H22FN3O5S

M.W.:
459.50

Type:
---

AlogP:
2.36

Polar Surface Area:
106.70

HBA:
9

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
4

Passes Ro3:
N

QED Weighted:
0.46

DETAILS

ALA5273363

Name:
(2R,3R,4R,5R)-4-fluoro-2-(hydroxymethyl)-4-methyl-5-(4-methyl-5-(thiophen-2Show More⌵

Mol. Formula:
C19H18FN3O3S

M.W.:
387.44

Type:
---

AlogP:
2.18

Polar Surface Area:
80.40

HBA:
7

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.66

DETAILS

ALA5286612

Name:
(2R,3R,4R,5R)-4-fluoro-2-(hydroxymethyl)-4-methyl-5-(4-methyl-5-((3-methylpShow More⌵

Mol. Formula:
C21H21FN4O3

M.W.:
396.42

Type:
---

AlogP:
1.82

Polar Surface Area:
93.29

HBA:
7

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.64

DETAILS

ALA5284240

Name:
(2R,3R,4R,5R)-5-(5-((4-bromophenyl)ethynyl)-4-methyl-7H-pyrrolo[2,3-d]pyrimShow More⌵

Mol. Formula:
C21H19BrFN3O3

M.W.:
460.30

Type:
---

AlogP:
2.88

Polar Surface Area:
80.40

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.58

DETAILS

ALA5284233

Name:
(2R,3R,4R,5R)-5-(5-(3,3-dimethylbut-1-yn-1-yl)-4-methyl-7H-pyrrolo[2,3-d]pyShow More⌵

Mol. Formula:
C19H24FN3O3

M.W.:
361.42

Type:
---

AlogP:
2.12

Polar Surface Area:
80.40

HBA:
6

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
2

Passes Ro3:
N

QED Weighted:
0.80

DETAILS

ALA5283922

Name:
(2R,3R,4R,5R)-4-fluoro-2-(hydroxymethyl)-5-(5-((4-methoxyphenyl)ethynyl)-4-Show More⌵

Mol. Formula:
C22H22FN3O4

M.W.:
411.43

Type:
---

AlogP:
2.13

Polar Surface Area:
89.63

HBA:
7

HBD:
2

#RO5 Violations:
---

#Rotatable Bonds:
3

Passes Ro3:
N

QED Weighted:
0.64

DETAILS