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YKL-05-099 Name:
3-(2-chloro-6-methylphenyl)-7-((2-methoxy-4-(1-methylpiperidin-4-yl)phenyl)Show More⌵
Mol. Formula:
C32H34ClN7O3
M.W.:
600.12
Type:
---
AlogP:
6.68
Polar Surface Area:
95.95
HBA:
8
HBD:
1
#RO5 Violations:
2
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.25
DETAILS
CLOSE
ALA5200656 Name:
8-(((2r,5r)-5-Amino-1,3-dioxan-2-yl)methyl)-6-(2-chloro-4-(pyridin-2-yl)pheShow More⌵
Mol. Formula:
C24H23ClN6O3
M.W.:
478.94
Type:
---
AlogP:
2.92
Polar Surface Area:
117.18
HBA:
9
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.45
DETAILS
CLOSE
ALA5194766 Name:
8-(((2r,5r)-5-Amino-1,3-dioxan-2-yl)methyl)-6-(2-chloro-4-(3-methylpyridin-Show More⌵
Mol. Formula:
C25H25ClN6O3
M.W.:
492.97
Type:
---
AlogP:
3.22
Polar Surface Area:
117.18
HBA:
9
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
CLOSE
ALA5194644 Name:
8-(((2r,5r)-5-Amino-1,3-dioxan-2-yl)methyl)-6-(2-chloro-4-(3-fluoro-6-methyShow More⌵
Mol. Formula:
C25H24ClFN6O3
M.W.:
510.96
Type:
---
AlogP:
3.36
Polar Surface Area:
117.18
HBA:
9
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
ALA5193137 Name:
8-(((2r,5r)-5-Amino-1,3-dioxan-2-yl)methyl)-6-(2-chloro-4-(3-methoxypyridinShow More⌵
Mol. Formula:
C25H25ClN6O4
M.W.:
508.97
Type:
---
AlogP:
2.92
Polar Surface Area:
126.41
HBA:
10
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA5189489 Name:
8-(((2r,5r)-5-Amino-1,3-dioxan-2-yl)methyl)-6-(2-chloro-4-(3-chloropyridin-Show More⌵
Mol. Formula:
C24H22Cl2N6O3
M.W.:
513.39
Type:
---
AlogP:
3.57
Polar Surface Area:
117.18
HBA:
9
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
ALA5187267 Name:
8-(((2r,5r)-5-Amino-1,3-dioxan-2-yl)methyl)-6-(2-chloro-4-(6-methoxypyridinShow More⌵
Mol. Formula:
C25H25ClN6O4
M.W.:
508.97
Type:
---
AlogP:
2.92
Polar Surface Area:
126.41
HBA:
10
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA5181636 Name:
8-(((2r,5r)-5-Amino-1,3-dioxan-2-yl)methyl)-6-(2-chloro-4-(6-(trifluoromethShow More⌵
Mol. Formula:
C25H22ClF3N6O3
M.W.:
546.94
Type:
---
AlogP:
3.93
Polar Surface Area:
117.18
HBA:
9
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.39
DETAILS
CLOSE
ALA5180834 Name:
8-(((2r,5r)-5-Amino-1,3-dioxan-2-yl)methyl)-6-(2-chloro-4-(6-methylpyridin-Show More⌵
Mol. Formula:
C31H29ClN6O4
M.W.:
585.06
Type:
---
AlogP:
4.93
Polar Surface Area:
126.41
HBA:
10
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.27
DETAILS
CLOSE
ALA5179229 Name:
8-(((2r,5r)-5-Amino-1,3-dioxan-2-yl)methyl)-6-(2-chloro-4-(4,6-(dimethyl)pyShow More⌵
Mol. Formula:
C26H27ClN6O3
M.W.:
506.99
Type:
---
AlogP:
3.53
Polar Surface Area:
117.18
HBA:
9
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
ALA5175296 Name:
8-(((2r,5r)-5-Amino-1,3-dioxan-2-yl)methyl)-6-(2-chloro-4-(6-(difluoromethyShow More⌵
Mol. Formula:
C25H23ClF2N6O3
M.W.:
528.95
Type:
---
AlogP:
3.85
Polar Surface Area:
117.18
HBA:
9
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.39
DETAILS
CLOSE
ALA5169576 Name:
8-(((2r,5r)-5-Amino-1,3-dioxan-2-yl)methyl)-6-(2-chloro-4-(3-methoxy-6-methShow More⌵
Mol. Formula:
C26H27ClN6O4
M.W.:
522.99
Type:
---
AlogP:
3.23
Polar Surface Area:
126.41
HBA:
10
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.39
DETAILS
CLOSE
ALA5090394 Name:
MRIA9
Mol. Formula:
C24H22ClFN6O3
M.W.:
496.93
Type:
Unknown
AlogP:
3.05
Polar Surface Area:
117.18
HBA:
9
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.43
DETAILS
CLOSE
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