Trypanosoma brucei
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ID: ALA612849
Type: ORGANISM
Organism: Trypanosoma brucei
Species Group: Trypanosoma brucei
Name:
3-[4-(4,5-Dihydro-1H-imidazol-2-yl)-benzylidene]-1-[4-(4,5-dihydro-1H-imidazol-2-yl)-phenyl]-piperidine
Mol. Formula:
C24H27N5
M.W.:
385.52
Type:
Small molecule
AlogP:
3.07
Polar Surface Area:
52.02
HBA:
5
HBD:
2
#RO5 Violations:
0
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.85
Name:
Pyridine-2,6-dicarboxylic acid bis-[(4-carbamimidoyl-phenyl)-amide]
Mol. Formula:
C21H19N7O2
M.W.:
401.43
Type:
Small molecule
AlogP:
2.15
Polar Surface Area:
170.83
HBA:
5
HBD:
6
#RO5 Violations:
1
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.27
Name:
1-[4-(4,5-Dihydro-1H-imidazol-2-yl)-benzyl]-4-[4-(4,5-dihydro-1H-imidazol-2-yl)-benzylidene]-piperidine
Mol. Formula:
C25H29N5
M.W.:
399.54
Type:
Small molecule
AlogP:
3.07
Polar Surface Area:
52.02
HBA:
5
HBD:
2
#RO5 Violations:
0
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.81
Name:
4-[4-(4,5-Dihydro-1H-imidazol-2-yl)-benzyl]-1-[4-(4,5-dihydro-1H-imidazol-2-yl)-phenyl]-piperidine
Mol. Formula:
C24H29N5
M.W.:
387.53
Type:
Small molecule
AlogP:
2.85
Polar Surface Area:
52.02
HBA:
5
HBD:
2
#RO5 Violations:
0
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.83
Name:
Cyclopropane-1,2-dicarboxylic acid bis-{[4-(4,5-dihydro-1H-imidazol-2-yl)-phenyl]-amide}
Mol. Formula:
C23H24N6O2
M.W.:
416.49
Type:
Small molecule
AlogP:
1.60
Polar Surface Area:
106.98
HBA:
6
HBD:
4
#RO5 Violations:
0
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.57
Name:
1,4-Bis-[4-(4,5-dihydro-1H-imidazol-2-yl)-phenyl]-piperazine
Mol. Formula:
C22H26N6
M.W.:
374.49
Type:
Small molecule
AlogP:
1.71
Polar Surface Area:
55.26
HBA:
6
HBD:
2
#RO5 Violations:
0
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.86
Name:
1,4-Bis-[4-(4,5-dihydro-1H-imidazol-2-yl)-phenyl]-[1,4]diazepane
Mol. Formula:
C23H28N6
M.W.:
388.52
Type:
Small molecule
AlogP:
2.10
Polar Surface Area:
55.26
HBA:
6
HBD:
2
#RO5 Violations:
0
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.84
Name:
3-[4-(4,5-Dihydro-1H-imidazol-2-yl)-benzyl]-1-[4-(4,5-dihydro-1H-imidazol-2-yl)-phenyl]-piperidine
Mol. Formula:
C24H29N5
M.W.:
387.53
Type:
Small molecule
AlogP:
2.85
Polar Surface Area:
52.02
HBA:
5
HBD:
2
#RO5 Violations:
0
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.83
Name:
4-(4-{4-[(E)-amino(imino)methyl]phenyl}piperazin-1-yl)benzenecarboximidamide
Mol. Formula:
C18H22N6
M.W.:
322.42
Type:
Small molecule
AlogP:
1.58
Polar Surface Area:
106.22
HBA:
4
HBD:
4
#RO5 Violations:
0
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.51