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ALA4513442 Name:
(S)-2-(1-(5-Acetyl-2-aminopyrimidin-4-yl)-azetidin
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Mol. Formula:
C21H18ClN7O2
M.W.:
435.88
Type:
Unknown
AlogP:
2.66
Polar Surface Area:
111.41
HBA:
9
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.49
DETAILS
CLOSE
ALA4539481 Name:
5-(4-((2-(Dimethylamino)ethyl)amino)quinazolin-6-y
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Mol. Formula:
C19H20N6O
M.W.:
348.41
Type:
Unknown
AlogP:
2.55
Polar Surface Area:
86.96
HBA:
7
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.73
DETAILS
CLOSE
ALA4536678 Name:
(S)-2-(1-(2-Amino-5-chloropyrimidin-4-yl)azetidin-
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Mol. Formula:
C19H15Cl2N7O
M.W.:
428.28
Type:
Unknown
AlogP:
3.12
Polar Surface Area:
94.34
HBA:
8
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.54
DETAILS
CLOSE
ALA4522342 Name:
(S)-2-(1-(5-Acetyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl
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Mol. Formula:
C24H19ClFN7O2
M.W.:
491.91
Type:
Unknown
AlogP:
4.09
Polar Surface Area:
101.18
HBA:
8
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA4520300 Name:
2-((2S,4S)-1-(5-Acetyl-7H-pyrrolo[2,3-d]pyrimidin-
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Mol. Formula:
C24H19ClFN7O2
M.W.:
491.91
Type:
Unknown
AlogP:
3.90
Polar Surface Area:
101.18
HBA:
8
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA4554377 Name:
(S)-2-(1-(2-Amino-5-ethynylpyrimidin-4-yl)azetidin
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Mol. Formula:
C21H16ClN7O
M.W.:
417.86
Type:
Unknown
AlogP:
2.44
Polar Surface Area:
94.34
HBA:
8
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.51
DETAILS
CLOSE
ALA4514752 Name:
(S)-4-(2-(5-Chloro-4-oxo-3-phenyl-3,4-dihydropyrro
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Mol. Formula:
C23H17ClN8O
M.W.:
456.90
Type:
Unknown
AlogP:
3.62
Polar Surface Area:
107.90
HBA:
8
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
CLOSE
ALA4549473 Name:
(S)-2-Amino-4-(2-(5-chloro-4-oxo-3-phenyl-3,4-dihy
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Mol. Formula:
C21H17ClN8O
M.W.:
432.88
Type:
Unknown
AlogP:
2.72
Polar Surface Area:
118.13
HBA:
9
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.53
DETAILS
CLOSE
ALA4548876 Name:
5-Chloro-2-((2S,4S)-4-fluoro-1-(9H-purin-6-yl)pyrr
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Mol. Formula:
C21H16ClFN8O
M.W.:
450.87
Type:
Unknown
AlogP:
3.09
Polar Surface Area:
97.00
HBA:
8
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.45
DETAILS
CLOSE
ALA4745196 Name:
2-[(1S)-1-(4-Fluorophenyl)ethyl]-7-methyl-5-[3-(py
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Mol. Formula:
C29H23FN4O
M.W.:
462.53
Type:
Unknown
AlogP:
6.46
Polar Surface Area:
61.88
HBA:
3
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.33
DETAILS
CLOSE
ALA4744874 Name:
2-[(1S)-1-Cyclopropylethyl]-N-methyl-6-[3-(1-methy
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Mol. Formula:
C25H26N6O3S
M.W.:
490.59
Type:
Unknown
AlogP:
3.29
Polar Surface Area:
112.98
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.43
DETAILS
CLOSE
ALA4744413 Name:
4-(5-{2-[(1S)-1-Cyclopropylethyl]-7-methyl-1-oxo-2
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Mol. Formula:
C29H24F3N3O3
M.W.:
519.52
Type:
Unknown
AlogP:
6.68
Polar Surface Area:
86.29
HBA:
3
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.31
DETAILS
CLOSE
ALA4744098 Name:
(+/-)-2-(1-Cyclopropylethyl)-7-methyl-5-{3H-[1,2,3
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Mol. Formula:
C19H19N5O
M.W.:
333.39
Type:
Unknown
AlogP:
3.08
Polar Surface Area:
74.77
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.80
DETAILS
CLOSE
ALA4744017 Name:
(S)-1-(2-(Cyclopropylmethoxy)propyl)-3-(4-methyl-5
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Mol. Formula:
C19H22N4O2S
M.W.:
370.48
Type:
Unknown
AlogP:
3.18
Polar Surface Area:
76.14
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.77
DETAILS
CLOSE
ALA4742917 Name:
5-[3-(2-Aminopyridin-4-yl)-1H-pyrrolo[2,3-b]pyridi
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Mol. Formula:
C26H25N5O
M.W.:
423.52
Type:
Unknown
AlogP:
4.94
Polar Surface Area:
87.90
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.49
DETAILS
CLOSE
ALA4742698 Name:
4-(5-{2-[(1S)-1-Cyclopropylethyl]-7-methyl-1-oxo-2
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Mol. Formula:
C29H27N3O3
M.W.:
465.55
Type:
Unknown
AlogP:
5.97
Polar Surface Area:
86.29
HBA:
3
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA4742357 Name:
NA
Mol. Formula:
C32H43NO12
M.W.:
633.69
Type:
Unknown
AlogP:
0.88
Polar Surface Area:
197.98
HBA:
13
HBD:
3
#RO5 Violations:
2
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.20
DETAILS
CLOSE
ALA4741907 Name:
2-tert-Butyl-7-methyl-5-[3-(pyridin-4-yl)-1H-pyrro
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Mol. Formula:
C25H24N4O
M.W.:
396.49
Type:
Unknown
AlogP:
5.35
Polar Surface Area:
61.88
HBA:
3
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.50
DETAILS
CLOSE
ALA4740643 Name:
4-(5-{2-[(1S)-1-cyclopropylethyl]-1-oxo-7-(trifluo
Show More⌵
Mol. Formula:
C29H24F3N3O3
M.W.:
519.52
Type:
Unknown
AlogP:
6.68
Polar Surface Area:
86.29
HBA:
3
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.31
DETAILS
CLOSE
ALA4740341 Name:
2-[(1S)-1-Cyclopropylethyl]-7-methyl-5-{3-[2-(trif
Show More⌵
Mol. Formula:
C27H23F3N4O
M.W.:
476.50
Type:
Unknown
AlogP:
6.37
Polar Surface Area:
61.88
HBA:
3
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
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