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ALA4791441 Name:
(((2R,3S,4R,5R)-5-(6-(cyclopentylamino)-2-o-tolyl-
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Mol. Formula:
C23H30N5O7P
M.W.:
519.50
Type:
Unknown
AlogP:
1.93
Polar Surface Area:
172.08
HBA:
10
HBD:
5
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.28
DETAILS
CLOSE
ALA4791237 Name:
((2R,3S,4R,5R)-5-(6-(benzylamino)-2-chloro-9H-puri
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Mol. Formula:
C17H20ClN5O10P2
M.W.:
551.77
Type:
Unknown
AlogP:
0.94
Polar Surface Area:
218.61
HBA:
12
HBD:
6
#RO5 Violations:
3
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.16
DETAILS
CLOSE
ALA4790960 Name:
5-(5-(3,3-difluorocyclobutyl)-6-methoxypyridazin-3
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Mol. Formula:
C13H12F2N4O3
M.W.:
310.26
Type:
Unknown
AlogP:
1.04
Polar Surface Area:
100.73
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.88
DETAILS
CLOSE
ALA4790958 Name:
4-((1S,2S)-2-(difluoromethyl)cyclopropyl)-6-(2,4-d
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Mol. Formula:
C13H9F2N5O2
M.W.:
305.24
Type:
Unknown
AlogP:
0.76
Polar Surface Area:
115.29
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.87
DETAILS
CLOSE
ALA4790529 Name:
{[{[(2R,3S,4R,5R)-5-(6-Chloro-4-{[(2-chlorophenyl)
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Mol. Formula:
C19H23Cl2N5O9P2
M.W.:
598.27
Type:
Unknown
AlogP:
2.36
Polar Surface Area:
198.38
HBA:
12
HBD:
5
#RO5 Violations:
2
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.17
DETAILS
CLOSE
ALA4790457 Name:
({2-[(2R,3S,4R,5R)-5-(6-Chloro-4-{[(2-chlorophenyl
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Mol. Formula:
C19H22Cl2N5O7P
M.W.:
534.29
Type:
Unknown
AlogP:
1.91
Polar Surface Area:
172.08
HBA:
10
HBD:
5
#RO5 Violations:
1
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.15
DETAILS
CLOSE
ALA4790401 Name:
2-(((2R,3S,4R,5R)-5-(6-(benzylamino)-2-chloro-9H-p
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Mol. Formula:
C19H23ClN5O7P
M.W.:
499.85
Type:
Unknown
AlogP:
0.91
Polar Surface Area:
172.08
HBA:
10
HBD:
5
#RO5 Violations:
---
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.16
DETAILS
CLOSE
ALA4790144 Name:
[[(2R,3S,4R,5R)-5-[4-(Benzylamino)-6-chloropyrazol
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Mol. Formula:
C18H22ClN5O9P2
M.W.:
549.80
Type:
Unknown
AlogP:
1.05
Polar Surface Area:
209.38
HBA:
11
HBD:
6
#RO5 Violations:
3
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.16
DETAILS
CLOSE
ALA4782237 Name:
(((2R,3S,4R,5R)-5-(2-chloro-6-((1-methyl-1H-pyrazo
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Mol. Formula:
C16H21ClN7O7P
M.W.:
489.81
Type:
Unknown
AlogP:
-0.40
Polar Surface Area:
189.90
HBA:
12
HBD:
5
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.20
DETAILS
CLOSE
ALA4782129 Name:
(((2R,3S,4R,5R)-5-(2-chloro-6-(pyrrolidin-1-yl)-9H
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Mol. Formula:
C15H21ClN5O7P
M.W.:
449.79
Type:
Unknown
AlogP:
-0.15
Polar Surface Area:
163.29
HBA:
10
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.34
DETAILS
CLOSE
ALA4782125 Name:
[({[(2S,3S,4R,5R)-5-(6-Chloro-4-{[(2-chlorophenyl)
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Mol. Formula:
C18H20Cl2N5O6PS
M.W.:
536.33
Type:
Unknown
AlogP:
2.23
Polar Surface Area:
162.85
HBA:
10
HBD:
5
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.21
DETAILS
CLOSE
ALA4781912 Name:
[2-({(2R,3S,4R,5R)-5-[6-Chloro-4-(cyclopentylamino
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Mol. Formula:
C20H32ClN6O7P
M.W.:
534.94
Type:
Unknown
AlogP:
0.93
Polar Surface Area:
175.32
HBA:
11
HBD:
5
#RO5 Violations:
2
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.23
DETAILS
CLOSE
ALA4781819 Name:
({(2R,3S,4R,5R)-5-[6-Chloro-4-(cyclopentylamino)-1
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Mol. Formula:
C17H23ClN5O9P
M.W.:
507.82
Type:
Unknown
AlogP:
0.06
Polar Surface Area:
209.38
HBA:
11
HBD:
6
#RO5 Violations:
3
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.21
DETAILS
CLOSE
ALA4547821 Name:
3-(6-(1-Methyl-1H-pyrazol-5-yl)-4-vinyl-1H-benzo[d
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Mol. Formula:
C18H15N5O
M.W.:
317.35
Type:
Unknown
AlogP:
3.17
Polar Surface Area:
68.76
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.63
DETAILS
CLOSE
ALA4547622 Name:
1-(1H-Indazol-6-yl)-6-(1-(2-methylbenzyl)-1H-pyraz
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Mol. Formula:
C24H19N7
M.W.:
405.47
Type:
Unknown
AlogP:
4.52
Polar Surface Area:
77.21
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.47
DETAILS
CLOSE
ALA4546738 Name:
3-[6-(1-Methyl-1H-pyrazol-4-yl)-[1,2,4]triazolo[4,
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Mol. Formula:
C16H13N5O
M.W.:
291.31
Type:
Unknown
AlogP:
2.50
Polar Surface Area:
68.24
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.62
DETAILS
CLOSE
ALA4549571 Name:
6-(1-(2,4-Dichlorobenzyl)-1H-pyrazol-5-yl)-1-(1H-i
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Mol. Formula:
C23H15Cl2N7
M.W.:
460.33
Type:
Unknown
AlogP:
5.52
Polar Surface Area:
77.21
HBA:
6
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA4549109 Name:
Sodium ethyl((4-(3'-((7H-purin-6-yl)carbamoyl)-[1,
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Mol. Formula:
C24H21N7NaO4P
M.W.:
525.44
Type:
Unknown
AlogP:
4.32
Polar Surface Area:
147.91
HBA:
8
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.27
DETAILS
CLOSE
ALA4756805 Name:
{2-({(2R,3S,4R,5R)-5-[6-Chloro-4-(cyclopentylamino
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Mol. Formula:
C20H32ClN6O9PS
M.W.:
599.00
Type:
Unknown
AlogP:
0.26
Polar Surface Area:
209.46
HBA:
12
HBD:
5
#RO5 Violations:
2
#Rotatable Bonds:
10
Passes Ro3:
N
QED Weighted:
0.18
DETAILS
CLOSE
ALA4755896 Name:
[[(2R,3R,4S,5R)-5-[2-Chloro-6-(ethylamino)purin-9-
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Mol. Formula:
C13H19ClFN5O8P2
M.W.:
489.72
Type:
Unknown
AlogP:
0.85
Polar Surface Area:
189.15
HBA:
10
HBD:
5
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.26
DETAILS
CLOSE
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