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ALA5088381 Name:
(S)-4-(6-(3,5-Dimethylisoxazol-4-yl)-1H-pyrrolo[2,3-b)pyridin-3-yl)-N-(pipeShow More⌵
Mol. Formula:
C22H23ClF3N7O
M.W.:
493.92
Type:
Unknown
AlogP:
4.47
Polar Surface Area:
104.55
HBA:
7
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.42
DETAILS
CLOSE
ALA4583127 Name:
Roridin F
Mol. Formula:
C30H42O9
M.W.:
546.66
Type:
Unknown
AlogP:
2.95
Polar Surface Area:
124.05
HBA:
9
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
11
Passes Ro3:
N
QED Weighted:
0.13
DETAILS
CLOSE
ALA4549565 Name:
Miophytocen D
Mol. Formula:
C29H40O9
M.W.:
532.63
Type:
Unknown
AlogP:
2.13
Polar Surface Area:
131.75
HBA:
9
HBD:
3
#RO5 Violations:
1
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.43
DETAILS
CLOSE
ALA4516810 Name:
Satratoxin I
Mol. Formula:
C29H38O10
M.W.:
546.61
Type:
Unknown
AlogP:
1.59
Polar Surface Area:
155.28
HBA:
9
HBD:
4
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.12
DETAILS
CLOSE
ALA2386203 Name:
2-(6-Hydroxy-2-naphthoxy)-1-ethyl beta-D-xylopyranoside
Mol. Formula:
C17H20O7
M.W.:
336.34
Type:
Small molecule
AlogP:
0.38
Polar Surface Area:
108.61
HBA:
7
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.58
DETAILS
CLOSE
ALA2386202 Name:
(2-(6-Hydroxy-naphthyl))-methyl beta-D-xylopyranoside
Mol. Formula:
C16H18O6
M.W.:
306.31
Type:
Small molecule
AlogP:
0.50
Polar Surface Area:
99.38
HBA:
6
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.66
DETAILS
CLOSE
ALA2386201 Name:
(2R,3R,4S,5R)-2-(2-(2-(2-(naphthalen-2-yloxy)ethoxy)ethoxy)ethoxy)tetrahydrShow More⌵
Mol. Formula:
C21H28O8
M.W.:
408.45
Type:
Small molecule
AlogP:
0.71
Polar Surface Area:
106.84
HBA:
8
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
11
Passes Ro3:
N
QED Weighted:
0.47
DETAILS
CLOSE
ALA2386200 Name:
(2R,3R,4S,5R)-2-(2-(2-(naphthalen-2-yloxy)ethoxy)ethoxy)tetrahydro-2H-pyranShow More⌵
Mol. Formula:
C19H24O7
M.W.:
364.39
Type:
Small molecule
AlogP:
0.69
Polar Surface Area:
97.61
HBA:
7
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.59
DETAILS
CLOSE
ALA2386199 Name:
2-(2-Naphthoxy)-1-ethyl beta-D-xylopyranoside
Mol. Formula:
C17H20O6
M.W.:
320.34
Type:
Small molecule
AlogP:
0.67
Polar Surface Area:
88.38
HBA:
6
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.70
DETAILS
CLOSE
ALA2386198 Name:
(2-Naphthyl)-methyl beta-D-xylopyranoside
Mol. Formula:
C16H18O5
M.W.:
290.31
Type:
Small molecule
AlogP:
0.80
Polar Surface Area:
79.15
HBA:
5
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
3
Passes Ro3:
N
QED Weighted:
0.78
DETAILS
CLOSE
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