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ALA4879309 Name:
N-phenyl-5-(3,4,5-trimethoxyphenyl)oxazole-2-carbo
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Mol. Formula:
C19H18N2O5
M.W.:
354.36
Type:
Unknown
AlogP:
3.62
Polar Surface Area:
82.82
HBA:
6
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.73
DETAILS
CLOSE
ALA4879148 Name:
Centiplide I
Mol. Formula:
C25H36O6
M.W.:
432.56
Type:
Unknown
AlogP:
4.38
Polar Surface Area:
78.90
HBA:
6
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.36
DETAILS
CLOSE
ALA4878793 Name:
NA
Mol. Formula:
C56H88O13
M.W.:
969.31
Type:
Unknown
AlogP:
10.96
Polar Surface Area:
138.83
HBA:
12
HBD:
1
#RO5 Violations:
3
#Rotatable Bonds:
11
Passes Ro3:
N
QED Weighted:
0.12
DETAILS
CLOSE
ALA4878668 Name:
NA
Mol. Formula:
C24H21N3O9
M.W.:
495.44
Type:
Unknown
AlogP:
2.77
Polar Surface Area:
144.41
HBA:
11
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.32
DETAILS
CLOSE
ALA4878655 Name:
NA
Mol. Formula:
C41H53NO15S
M.W.:
831.93
Type:
Unknown
AlogP:
1.14
Polar Surface Area:
237.12
HBA:
15
HBD:
4
#RO5 Violations:
2
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.18
DETAILS
CLOSE
ALA4878539 Name:
(S)-5-(4-(2-methoxyethoxy)-3-(trifluoromethyl)phen
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Mol. Formula:
C14H15F3N2O4
M.W.:
332.28
Type:
Unknown
AlogP:
2.56
Polar Surface Area:
69.15
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.84
DETAILS
CLOSE
ALA4878342 Name:
N-(4-chlorophenyl)-5-phenyloxazole-2-carboxamide
Mol. Formula:
C16H11ClN2O2
M.W.:
298.73
Type:
Unknown
AlogP:
4.25
Polar Surface Area:
55.13
HBA:
3
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.79
DETAILS
CLOSE
ALA4878219 Name:
(5-phenyloxazol-2-yl)(4-phenylpiperazin-1-yl)metha
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Mol. Formula:
C20H19N3O2
M.W.:
333.39
Type:
Unknown
AlogP:
3.30
Polar Surface Area:
49.58
HBA:
4
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.74
DETAILS
CLOSE
ALA4878114 Name:
Microhelenalin B
Cas Number:
63569-08-4
Mol. Formula:
C20H28O5
M.W.:
348.44
Type:
Unknown
AlogP:
2.92
Polar Surface Area:
69.67
HBA:
5
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.73
DETAILS
CLOSE
ALA4877953 Name:
4-(3,4-Difluorophenoxy)-N-(oxazol-2-yl)picolinamid
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Mol. Formula:
C15H9F2N3O3
M.W.:
317.25
Type:
Unknown
AlogP:
3.39
Polar Surface Area:
77.25
HBA:
5
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.80
DETAILS
CLOSE
ALA4877489 Name:
2-(4-methoxyphenyl)-7-(3,4,5-trimethoxyphenyl)-[1,
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Mol. Formula:
C21H20N4O4
M.W.:
392.42
Type:
Unknown
AlogP:
3.49
Polar Surface Area:
80.00
HBA:
8
HBD:
---
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.50
DETAILS
CLOSE
ALA4877414 Name:
NA
Mol. Formula:
C39H35FN2O8
M.W.:
678.71
Type:
Unknown
AlogP:
6.69
Polar Surface Area:
98.97
HBA:
10
HBD:
---
#RO5 Violations:
2
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.13
DETAILS
CLOSE
ALA4877275 Name:
NA
Mol. Formula:
C41H66O9
M.W.:
702.97
Type:
Unknown
AlogP:
7.73
Polar Surface Area:
112.91
HBA:
8
HBD:
2
#RO5 Violations:
2
#Rotatable Bonds:
9
Passes Ro3:
N
QED Weighted:
0.18
DETAILS
CLOSE
ALA4877274 Name:
N-(4-(diethylamino)phenyl)-5-phenyloxazole-2-carbo
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Mol. Formula:
C20H21N3O2
M.W.:
335.41
Type:
Unknown
AlogP:
4.44
Polar Surface Area:
58.37
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.72
DETAILS
CLOSE
ALA4877229 Name:
(S)-6-methyl-5-(4-propoxy-3-(trifluoromethyl)pheny
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Mol. Formula:
C14H15F3N2O3
M.W.:
316.28
Type:
Unknown
AlogP:
3.33
Polar Surface Area:
59.92
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.93
DETAILS
CLOSE
ALA4877040 Name:
2-(3,4-Dichlorophenyl)-N-(oxazol-2-yl)isonicotinam
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Mol. Formula:
C15H9Cl2N3O2
M.W.:
334.16
Type:
Unknown
AlogP:
4.30
Polar Surface Area:
68.02
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.78
DETAILS
CLOSE
ALA4877014 Name:
N-(Oxazol-2-yl)-4-(3-(trifluoromethyl)phenyl)picol
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Mol. Formula:
C16H10F3N3O2
M.W.:
333.27
Type:
Unknown
AlogP:
4.01
Polar Surface Area:
68.02
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.79
DETAILS
CLOSE
ALA4876937 Name:
(S)-6-methyl-5-(3-(trifluoromethyl)-4-(3,3,3-trifl
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Mol. Formula:
C14H12F6N2O3
M.W.:
370.25
Type:
Unknown
AlogP:
3.87
Polar Surface Area:
59.92
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.82
DETAILS
CLOSE
ALA4876912 Name:
NA
Mol. Formula:
C41H50BrNO14
M.W.:
860.75
Type:
Unknown
AlogP:
2.05
Polar Surface Area:
220.05
HBA:
14
HBD:
4
#RO5 Violations:
2
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.19
DETAILS
CLOSE
ALA4876794 Name:
N-(4-methoxyphenyl)-5-phenyloxazole-2-carboxamide
Mol. Formula:
C17H14N2O3
M.W.:
294.31
Type:
Unknown
AlogP:
3.60
Polar Surface Area:
64.36
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.80
DETAILS
CLOSE
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