ALA1802840Name:
(E)-3-(3-(Quinazolin-2-ylamino)phenyl)acrylic AcidMol. Formula:
C17H13N3O2M.W.:
291.31Type:
Small moleculeAlogP:
3.47Polar Surface Area:
75.11HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.72DETAILS
ALA1802839Name:
(E)-3-(3-(1H-Benzo[d]imidazol-2-ylamino)phenyl)acrylic AcidMol. Formula:
C16H13N3O2M.W.:
279.30Type:
Small moleculeAlogP:
3.40Polar Surface Area:
78.01HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.64DETAILS
ALA1802768Name:
(E)-2-Methyl-3-(3-(quinoxalin-3-ylamino)phenyl)acrylic AcidMol. Formula:
C18H15N3O2M.W.:
305.34Type:
Small moleculeAlogP:
3.86Polar Surface Area:
75.11HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.72DETAILS
ALA1802767Name:
(E)-3-(3-(Quinoxalin-3-yloxy)phenyl)acrylic AcidMol. Formula:
C17H12N2O3M.W.:
292.29Type:
Small moleculeAlogP:
3.52Polar Surface Area:
72.31HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.74DETAILS
ALA1802766Name:
3-(3-(Quinoxalin-3-ylamino)phenyl)propanoic AcidMol. Formula:
C17H15N3O2M.W.:
293.33Type:
Small moleculeAlogP:
3.39Polar Surface Area:
75.11HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.75DETAILS- ALA1802765
Name:
(E)-Ethyl 3-(3-(quinoxalin-3-ylamino)phenyl)acrylateMol. Formula:
C19H17N3O2M.W.:
319.36Type:
Small moleculeAlogP:
3.95Polar Surface Area:
64.11HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.57DETAILS - ALA1802764
Name:
N-(2,3-Dihydrobenzo[b][1,4]dioxin-6-yl)quinoxalin-2-amineMol. Formula:
C16H13N3O2M.W.:
279.30Type:
Small moleculeAlogP:
3.14Polar Surface Area:
56.27HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.78DETAILS - ALA1802763
Name:
(E)-3-(3-(Quinoxalin-3-ylamino)phenyl)acrylic AcidMol. Formula:
C17H13N3O2M.W.:
291.31Type:
Small moleculeAlogP:
3.47Polar Surface Area:
75.11HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.72DETAILS - ALA1802762
Name:
3-(3-(6-Nitroquinoxalin-3-ylamino)phenyl)propanoic AcidMol. Formula:
C17H14N4O4M.W.:
338.32Type:
Small moleculeAlogP:
3.30Polar Surface Area:
118.25HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.52DETAILS -
Type:
Small moleculeAlogP:
3.28Polar Surface Area:
80.95HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.58DETAILS -
Type:
Small moleculeAlogP:
3.68Polar Surface Area:
90.18HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.57DETAILS - ALA1802759
Name:
5-(6-Nitroquinoxalin-3-ylamino)-2-chlorobenzoic acidMol. Formula:
C15H9ClN4O4M.W.:
344.71Type:
Small moleculeAlogP:
3.63Polar Surface Area:
118.25HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.55DETAILS - ALA1802758
Name:
N-(2,3-Dihydrobenzo[b][1,4]dioxin-6-yl)-7-nitroquinoxalin-2-amineMol. Formula:
C16H12N4O4M.W.:
324.30Type:
Small moleculeAlogP:
3.05Polar Surface Area:
99.41HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.58DETAILS - ALA1802757
Name:
(E)-ethyl 3-(3-(6-nitroquinoxalin-3-ylamino)phenyl)acrylateMol. Formula:
C19H16N4O4M.W.:
364.36Type:
Small moleculeAlogP:
3.86Polar Surface Area:
107.25HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.31DETAILS - ALA1802756
Name:
(E)-3-(3-(6-Nitroquinoxalin-2-ylamino)phenyl)acrylic AcidMol. Formula:
C17H12N4O4M.W.:
336.31Type:
Small moleculeAlogP:
3.38Polar Surface Area:
118.25HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.42DETAILS - ALA1802755
Name:
(E)-3-(3-(6-Nitroquinoxalin-3-ylamino)phenyl)acrylic AcidMol. Formula:
C17H12N4O4M.W.:
336.31Type:
Small moleculeAlogP:
3.38Polar Surface Area:
118.25HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.42DETAILS - ALA1802754
Name:
1,1'-(6-Aminoquinoxaline-2,3-diyl)bis(piperidine-4-carboxylic Acid)Mol. Formula:
C20H25N5O4M.W.:
399.45Type:
Small moleculeAlogP:
1.81Polar Surface Area:
132.88HBA:
7HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.66DETAILS - ALA1802753
Name:
Diethyl 1,1'-(6-aminoquinoxaline-2,3-diyl)dipiperidine-4-carboxylateMol. Formula:
C24H33N5O4M.W.:
455.56Type:
Small moleculeAlogP:
2.77Polar Surface Area:
110.88HBA:
9HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.52DETAILS -
Type:
Small moleculeAlogP:
5.80Polar Surface Area:
122.67HBA:
8HBD:
3#RO5 Violations:
2#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.18DETAILS -
Type:
Small moleculeAlogP:
7.29Polar Surface Area:
102.44HBA:
8HBD:
2#RO5 Violations:
2#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.15DETAILS
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