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ALA4782104 Name:
7-(Diethylamino)-N-hydroxy-2-oxo-2H-chromene-3-car
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Mol. Formula:
C14H16N2O4
M.W.:
276.29
Type:
Unknown
AlogP:
1.76
Polar Surface Area:
82.78
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.50
DETAILS
CLOSE
ALA4781591 Name:
7-[(3-Bromobenzyl)oxy]-2-oxo-2H-chromene-3-carbohy
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Mol. Formula:
C17H13BrN2O4
M.W.:
389.20
Type:
Unknown
AlogP:
2.74
Polar Surface Area:
94.56
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.31
DETAILS
CLOSE
ALA4525407 Name:
Asperversiamide I
Mol. Formula:
C26H31N3O5
M.W.:
465.55
Type:
Unknown
AlogP:
2.63
Polar Surface Area:
100.13
HBA:
6
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
2
Passes Ro3:
N
QED Weighted:
0.58
DETAILS
CLOSE
ALA4754071 Name:
7-(Diethylamino)-2-oxo-2H-chromene-3-carbohydrazid
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Cas Number:
100343-98-4
Mol. Formula:
C14H17N3O3
M.W.:
275.31
Type:
Unknown
AlogP:
1.24
Polar Surface Area:
88.57
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.38
DETAILS
CLOSE
ALA4796275 Name:
7-(Diethylamino)-2-oxo-N'-[1-(thiophen-2-yl)ethyli
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Mol. Formula:
C20H21N3O3S
M.W.:
383.47
Type:
Unknown
AlogP:
3.85
Polar Surface Area:
74.91
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA4793683 Name:
7-(Diethylamino)-N-(2-hydroxyethyl)-2-oxo-2H-chrom
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Mol. Formula:
C16H20N2O4
M.W.:
304.35
Type:
Unknown
AlogP:
1.36
Polar Surface Area:
82.78
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.79
DETAILS
CLOSE
ALA4792716 Name:
N,N'-(ethane-1,2-diyl)bis(7-(benzyloxy)-2-oxo-2H-c
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Mol. Formula:
C36H28N2O8
M.W.:
616.63
Type:
Unknown
AlogP:
5.22
Polar Surface Area:
137.08
HBA:
8
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
11
Passes Ro3:
N
QED Weighted:
0.15
DETAILS
CLOSE
ALA4560821 Name:
Asperversiamide P
Mol. Formula:
C26H31N3O5
M.W.:
465.55
Type:
Unknown
AlogP:
2.47
Polar Surface Area:
107.97
HBA:
5
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.59
DETAILS
CLOSE
ALA4799604 Name:
N,N'-(ethane-1,2-diyl)bis(7-((4-nitrobenzyl)oxy)-2
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Mol. Formula:
C36H26N4O12
M.W.:
706.62
Type:
Unknown
AlogP:
5.03
Polar Surface Area:
223.36
HBA:
12
HBD:
2
#RO5 Violations:
3
#Rotatable Bonds:
13
Passes Ro3:
N
QED Weighted:
0.07
DETAILS
CLOSE
ALA4798512 Name:
2-Oxo-7-propoxy-2H-chromene-3-carbohydrazide
Mol. Formula:
C13H14N2O4
M.W.:
262.26
Type:
Unknown
AlogP:
1.19
Polar Surface Area:
94.56
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.37
DETAILS
CLOSE
ALA4783782 Name:
7-(Benzyloxy)-N-hydroxy-2-oxo-2H-chromene-3-carbox
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Mol. Formula:
C17H13NO5
M.W.:
311.29
Type:
Unknown
AlogP:
2.49
Polar Surface Area:
88.77
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.44
DETAILS
CLOSE
ALA4762756 Name:
7-(Benzyloxy)-N-(2-hydroxyethyl)-2-oxo-2H-chromene
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Mol. Formula:
C19H17NO5
M.W.:
339.35
Type:
Unknown
AlogP:
2.09
Polar Surface Area:
88.77
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.67
DETAILS
CLOSE
ALA4761109 Name:
7-(Diethylamino)-2-oxo-N'-[1-(pyridin-3-yl)ethylid
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Mol. Formula:
C21H22N4O3
M.W.:
378.43
Type:
Unknown
AlogP:
3.19
Polar Surface Area:
87.80
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.40
DETAILS
CLOSE
ALA4760594 Name:
N,N'-(ethane-1,2-diyl)bis(7-((3-bromobenzyl)oxy)-2
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Mol. Formula:
C36H26Br2N2O8
M.W.:
774.42
Type:
Unknown
AlogP:
6.74
Polar Surface Area:
137.08
HBA:
8
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
11
Passes Ro3:
N
QED Weighted:
0.11
DETAILS
CLOSE
ALA4788587 Name:
7-(benzyloxy)-2-oxo-N-phenyl-2H-chromene-3-carboxa
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Mol. Formula:
C23H17NO4
M.W.:
371.39
Type:
Unknown
AlogP:
4.62
Polar Surface Area:
68.54
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.52
DETAILS
CLOSE
ALA4787712 Name:
N-(2-hydroxyethyl)-7-[(4-nitrobenzyl)oxy]-2-oxo-2H
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Mol. Formula:
C19H16N2O7
M.W.:
384.34
Type:
Unknown
AlogP:
2.00
Polar Surface Area:
131.91
HBA:
7
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.36
DETAILS
CLOSE
ALA4786605 Name:
7-(Benzyloxy)-2-oxo-2H-chromene-3-carbohydrazide
Mol. Formula:
C17H14N2O4
M.W.:
310.31
Type:
Unknown
AlogP:
1.98
Polar Surface Area:
94.56
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.33
DETAILS
CLOSE
ALA4750177 Name:
7-[(3-Bromobenzyl)oxy]-N-(2-hydroxyethyl)-2-oxo-2H
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Mol. Formula:
C19H16BrNO5
M.W.:
418.24
Type:
Unknown
AlogP:
2.86
Polar Surface Area:
88.77
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.60
DETAILS
CLOSE
ALA4749056 Name:
7-Ethoxy-N-(2-hydroxyethyl)-2-oxo-2H-chromene-3-ca
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Mol. Formula:
C14H15NO5
M.W.:
277.28
Type:
Unknown
AlogP:
0.91
Polar Surface Area:
88.77
HBA:
5
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.79
DETAILS
CLOSE
ALA4747135 Name:
N-cyclopropyl-7-(diethylamino)-2-oxo-2H-chromene-3
Show More⌵
Mol. Formula:
C17H20N2O3
M.W.:
300.36
Type:
Unknown
AlogP:
2.53
Polar Surface Area:
62.55
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.86
DETAILS
CLOSE
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