Type:
---AlogP:
2.82Polar Surface Area:
65.07HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.58DETAILS
Type:
UnknownAlogP:
5.93Polar Surface Area:
111.44HBA:
8HBD:
2#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.25DETAILS
ALA4586041Name:
N-(3,5-bis(trifluoromethyl)phenyl)-3-chloroquinoxalin-2-amineMol. Formula:
C16H8ClF6N3M.W.:
391.70Type:
UnknownAlogP:
6.06Polar Surface Area:
37.81HBA:
3HBD:
1#RO5 Violations:
1#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.54DETAILS
ALA4585532Name:
(E)-3-(4-((4-Hydroxybenzoyl)oxy)styryl)phenyl 4-hydroxybenzoateMol. Formula:
C28H20O6M.W.:
452.46Type:
UnknownAlogP:
5.71Polar Surface Area:
93.06HBA:
6HBD:
2#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.22DETAILS
ALA4584915Name:
N2,N3-bis(3,5-dichlorophenyl)quinoxaline-2,3-diamineMol. Formula:
C20H12Cl4N4M.W.:
450.16Type:
UnknownAlogP:
7.73Polar Surface Area:
49.84HBA:
4HBD:
2#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.33DETAILS- ALA4584180
Name:
Methylenebis(4,1-phenylene) bis(3,4,5-trihydroxybenzoate)Mol. Formula:
C27H20O10M.W.:
504.45Type:
UnknownAlogP:
3.95Polar Surface Area:
173.98HBA:
10HBD:
6#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.13DETAILS - ALA4575663
Name:
N2,N3-bis(3-ethynylphenyl)quinoxaline-2,3,6-triamineMol. Formula:
C24H17N5M.W.:
375.44Type:
UnknownAlogP:
4.66Polar Surface Area:
75.86HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.36DETAILS - ALA4575444
Name:
N2,N3-bis(3-nitrophenyl)quinoxaline-2,3-diamineMol. Formula:
C20H14N6O4M.W.:
402.37Type:
UnknownAlogP:
4.93Polar Surface Area:
136.12HBA:
8HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.34DETAILS - ALA4575172
Name:
(E)-Ethene-1,2-diylbis(4,1-phenylene) bis(3,4,5-trihydroxybenzoate)Mol. Formula:
C28H20O10M.W.:
516.46Type:
UnknownAlogP:
4.53Polar Surface Area:
173.98HBA:
10HBD:
6#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.09DETAILS - ALA4572121
Name:
Methylenebis(2,1-phenylene) bis(3,4,5-trihydroxybenzoate)Mol. Formula:
C27H20O10M.W.:
504.45Type:
UnknownAlogP:
3.95Polar Surface Area:
173.98HBA:
10HBD:
6#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.13DETAILS - ALA4570486
Name:
N2,N3-bis(4-phenoxyphenyl)quinoxaline-2,3-diamineMol. Formula:
C32H24N4O2M.W.:
496.57Type:
UnknownAlogP:
8.70Polar Surface Area:
68.30HBA:
6HBD:
2#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.22DETAILS - ALA4569035
Name:
3-chloro-N-(3-(trifluoromethyl)phenyl)quinoxalin-2-amineMol. Formula:
C15H9ClF3N3M.W.:
323.70Type:
UnknownAlogP:
5.05Polar Surface Area:
37.81HBA:
3HBD:
1#RO5 Violations:
1#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.72DETAILS - ALA4568710
Name:
3-chloro-N-(4-(trifluoromethoxy)phenyl)quinoxalin-2-amineMol. Formula:
C15H9ClF3N3OM.W.:
339.70Type:
UnknownAlogP:
4.93Polar Surface Area:
47.04HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.73DETAILS - ALA4559219
Name:
methyl 2,3-bis(4-(trifluoromethoxy)phenylamino)quinoxaline-6-carboxylateMol. Formula:
C24H16F6N4O4M.W.:
538.40Type:
UnknownAlogP:
6.70Polar Surface Area:
94.60HBA:
8HBD:
2#RO5 Violations:
2#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.20DETAILS - ALA4558242
Name:
3-chloro-N-[4-(pentafluoro-lambda6-sulfanyl)phenyl]quinoxalin-2-amineMol. Formula:
C14H9ClF5N3SM.W.:
381.76Type:
UnknownAlogP:
6.68Polar Surface Area:
37.81HBA:
3HBD:
1#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.51DETAILS - ALA4555777
Name:
N2,N3-bis(4-chloro-3-(trifluoromethyl)phenyl)quinoxaline-2,3-diamineMol. Formula:
C22H12Cl2F6N4M.W.:
517.26Type:
UnknownAlogP:
8.46Polar Surface Area:
49.84HBA:
4HBD:
2#RO5 Violations:
2#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.27DETAILS - ALA4555517
Name:
N2,N3-bis(3-bromophenyl)-6-nitroquinoxaline-2,3-diamineMol. Formula:
C20H13Br2N5O2M.W.:
515.17Type:
UnknownAlogP:
6.55Polar Surface Area:
92.98HBA:
6HBD:
2#RO5 Violations:
2#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.23DETAILS - ALA4555189
Name:
N2,N3-bis(4-(trifluoromethoxy)phenyl)quinoxaline-2,3-diamineMol. Formula:
C22H14F6N4O2M.W.:
480.37Type:
UnknownAlogP:
6.91Polar Surface Area:
68.30HBA:
6HBD:
2#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.29DETAILS -
Type:
UnknownAlogP:
4.19Polar Surface Area:
86.99HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.28DETAILS - ALA4552349
Name:
6-chloro-N2,N3-bis(4-(trifluoromethoxy)phenyl)quinoxaline-2,3-diamineMol. Formula:
C22H13ClF6N4O2M.W.:
514.81Type:
UnknownAlogP:
7.57Polar Surface Area:
68.30HBA:
6HBD:
2#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.26DETAILS
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