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ALA4513483 Name:
2,4-Dibromo-N'-(5-bromo-2-hydroxybenzylidene)benzo
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Mol. Formula:
C14H9Br3N2O2
M.W.:
476.95
Type:
Unknown
AlogP:
4.44
Polar Surface Area:
61.69
HBA:
3
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.51
DETAILS
CLOSE
ALA4513251 Name:
3,4-Dibromo-N'-(3,5-dibromo-2-hydroxybenzylidene)b
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Mol. Formula:
C14H8Br4N2O2
M.W.:
555.85
Type:
Unknown
AlogP:
5.21
Polar Surface Area:
61.69
HBA:
3
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA4483731 Name:
9-(3-(4-(4-Methoxyphenyl)piperazin-1-yl)propyl)-2,
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Mol. Formula:
C25H32N4O
M.W.:
404.56
Type:
Unknown
AlogP:
3.51
Polar Surface Area:
32.67
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.68
DETAILS
CLOSE
ALA4482883 Name:
2,4-Dibromo-N'-(5-fluoro-2-hydroxybenzylidene)benz
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Mol. Formula:
C14H9Br2FN2O2
M.W.:
416.04
Type:
Unknown
AlogP:
3.82
Polar Surface Area:
61.69
HBA:
3
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.59
DETAILS
CLOSE
ALA4476170 Name:
2,3-Dibromo-N'-(2-hydroxy-5-methylbenzylidene)benz
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Mol. Formula:
C15H12Br2N2O2
M.W.:
412.08
Type:
Unknown
AlogP:
3.99
Polar Surface Area:
61.69
HBA:
3
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.59
DETAILS
CLOSE
ALA4475362 Name:
3-(3-(4-((6-fluoropyridin-2-yl)oxy)benzyl)isoxazol
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Mol. Formula:
C20H15FN4O2
M.W.:
362.36
Type:
Unknown
AlogP:
4.24
Polar Surface Area:
87.06
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.53
DETAILS
CLOSE
ALA4475183 Name:
9-(3-(4-Chlorophenoxy)propyl)-6-methyl-2,3,4,9-tet
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Mol. Formula:
C23H24ClF3N2O3
M.W.:
468.90
Type:
Unknown
AlogP:
4.72
Polar Surface Area:
26.19
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.67
DETAILS
CLOSE
ALA4475167 Name:
N-(3-(3,4-dihydro-1H-pyrido[3,4-b]indol-9(2H)-yl)p
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Mol. Formula:
C22H23F4N3O2
M.W.:
437.44
Type:
Unknown
AlogP:
3.93
Polar Surface Area:
28.99
HBA:
3
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.70
DETAILS
CLOSE
ALA4474956 Name:
9-(3-(2-Methoxyphenoxy)propyl)-2,3,4,9-tetrahydro-
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Mol. Formula:
C23H25F3N2O4
M.W.:
450.46
Type:
Unknown
AlogP:
3.76
Polar Surface Area:
35.42
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.70
DETAILS
CLOSE
ALA4474449 Name:
3-Bromo-N'-(4-bromo-2-hydroxybenzylidene)benzohydr
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Mol. Formula:
C14H10Br2N2O2
M.W.:
398.05
Type:
Unknown
AlogP:
3.68
Polar Surface Area:
61.69
HBA:
3
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.61
DETAILS
CLOSE
ALA4474150 Name:
5-((5-(2-aminopyridin-3-yl)isoxazol-3-yl)methyl)-N
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Mol. Formula:
C20H16FN5O
M.W.:
361.38
Type:
Unknown
AlogP:
4.19
Polar Surface Area:
89.86
HBA:
6
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.55
DETAILS
CLOSE
ALA4540750 Name:
3-(3-(4-((5-fluorofuran-2-yl)methyl)benzyl)isoxazo
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Mol. Formula:
C20H16FN3O2
M.W.:
349.37
Type:
Unknown
AlogP:
4.23
Polar Surface Area:
78.08
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.58
DETAILS
CLOSE
ALA4539328 Name:
3-Ethylthieno[3',2':4,5]benzo[1,2-d]isoxazole-4,8-
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Mol. Formula:
C11H7NO3S
M.W.:
233.25
Type:
Unknown
AlogP:
2.07
Polar Surface Area:
60.17
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.65
DETAILS
CLOSE
ALA4538831 Name:
3-(3-((6-(3-fluorophenoxy)pyridin-3-yl)methyl)isox
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Mol. Formula:
C20H15FN4O2
M.W.:
362.36
Type:
Unknown
AlogP:
4.24
Polar Surface Area:
87.06
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.57
DETAILS
CLOSE
ALA4538760 Name:
9-(3-(4-Chlorophenoxy)propyl)-7-methoxy-2,3,4,9-te
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Mol. Formula:
C23H24ClF3N2O4
M.W.:
484.90
Type:
Unknown
AlogP:
4.42
Polar Surface Area:
35.42
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.65
DETAILS
CLOSE
ALA4538179 Name:
2,4-Dibromo-N'-(2-hydroxy-5-trifluoromethoxybenzyl
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Mol. Formula:
C15H9Br2F3N2O3
M.W.:
482.05
Type:
Unknown
AlogP:
4.58
Polar Surface Area:
70.92
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.50
DETAILS
CLOSE
ALA4538113 Name:
9-(3-(4-Chlorophenoxy)propyl)-8-methoxy-2,3,4,9-te
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Mol. Formula:
C23H24ClF3N2O4
M.W.:
484.90
Type:
Unknown
AlogP:
4.42
Polar Surface Area:
35.42
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.65
DETAILS
CLOSE
ALA4537436 Name:
2,5-Dibromo-N'-(4-bromo-2-hydroxybenzylidene)benzo
Show More⌵
Mol. Formula:
C14H9Br3N2O2
M.W.:
476.95
Type:
Unknown
AlogP:
4.44
Polar Surface Area:
61.69
HBA:
3
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.51
DETAILS
CLOSE
ALA4536949 Name:
3,4-Dibromo-N'-(4-bromo-2-hydroxybenzylidene)benzo
Show More⌵
Mol. Formula:
C14H9Br3N2O2
M.W.:
476.95
Type:
Unknown
AlogP:
4.44
Polar Surface Area:
61.69
HBA:
3
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.51
DETAILS
CLOSE
ALA4536097 Name:
2-Fluoro-4-trifluoromethoxy-N'-(5-bromo-2-hydroxyb
Show More⌵
Mol. Formula:
C15H9BrF4N2O3
M.W.:
421.14
Type:
Unknown
AlogP:
3.96
Polar Surface Area:
70.92
HBA:
4
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.45
DETAILS
CLOSE
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