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ALA3249711 Name:
3-(((13S,17S)-3,17-dihydroxy-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydroShow More⌵
Mol. Formula:
C21H25N3O3S
M.W.:
399.52
Type:
Small molecule
AlogP:
3.28
Polar Surface Area:
96.98
HBA:
6
HBD:
3
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.68
DETAILS
CLOSE
ALA3249710 Name:
2-((8R,9S,13S,14S,17S)-3,17-dihydroxy-13-methyl-7,8,9,11,12,13,14,15,16,17-Show More⌵
Mol. Formula:
C19H25N3O2S
M.W.:
359.50
Type:
Small molecule
AlogP:
2.60
Polar Surface Area:
90.87
HBA:
4
HBD:
4
#RO5 Violations:
---
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.46
DETAILS
CLOSE
ALA3249709 Name:
(8R,9S,13S,14S,17S)-1,13-dimethyl-6-phenyl-9,11,12,13,14,15,16,17-octahydroShow More⌵
Mol. Formula:
C25H28O2
M.W.:
360.50
Type:
Small molecule
AlogP:
5.42
Polar Surface Area:
40.46
HBA:
2
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.71
DETAILS
CLOSE
ALA3249708 Name:
3,17beta-Dihydroxy-6-phenylestra-1,3,5(10),6-tetraene
Mol. Formula:
C24H26O2
M.W.:
346.47
Type:
Small molecule
AlogP:
5.11
Polar Surface Area:
40.46
HBA:
2
HBD:
2
#RO5 Violations:
1
#Rotatable Bonds:
1
Passes Ro3:
N
QED Weighted:
0.75
DETAILS
CLOSE
ALA3249707 Name:
(8R,9S,13S,14S,17S)-6-benzyl-3-(2-(diethylamino)ethoxy)-13-methyl-9,11,12,1Show More⌵
Mol. Formula:
C31H42ClNO2
M.W.:
496.14
Type:
Small molecule
AlogP:
6.32
Polar Surface Area:
32.70
HBA:
3
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
8
Passes Ro3:
N
QED Weighted:
0.50
DETAILS
CLOSE
ALA3249706 Name:
(8R,9S,13S,14S,17S)-3-(2-(dimethylamino)ethoxy)-1,13-dimethyl-6-phenyl-9,11Show More⌵
Mol. Formula:
C29H38ClNO2
M.W.:
468.08
Type:
Small molecule
AlogP:
5.65
Polar Surface Area:
32.70
HBA:
3
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.66
DETAILS
CLOSE
ALA3249319 Name:
(8R,9S,13S,14S,17S)-3-(2-(diethylamino)ethoxy)-13-methyl-6-phenyl-9,11,12,1Show More⌵
Mol. Formula:
C30H40ClNO2
M.W.:
482.11
Type:
Small molecule
AlogP:
6.12
Polar Surface Area:
32.70
HBA:
3
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
7
Passes Ro3:
N
QED Weighted:
0.56
DETAILS
CLOSE
ALA3249318 Name:
(8R,9S,13S,14S,17S)-3-(2-(dimethylamino)ethoxy)-17-hydroxy-13-methyl-7,8,9,Show More⌵
Mol. Formula:
C22H32ClNO3
M.W.:
393.96
Type:
Small molecule
AlogP:
3.48
Polar Surface Area:
49.77
HBA:
4
HBD:
1
#RO5 Violations:
---
#Rotatable Bonds:
4
Passes Ro3:
N
QED Weighted:
0.90
DETAILS
CLOSE
ALA3249317 Name:
(8R,9S,13S,14S,17S)-3,17-dihydroxy-1,13-dimethyl-7,8,9,11,12,13,14,15,16,17Show More⌵
Mol. Formula:
C19H24O3
M.W.:
300.40
Type:
Small molecule
AlogP:
3.56
Polar Surface Area:
57.53
HBA:
3
HBD:
2
#RO5 Violations:
---
#Rotatable Bonds:
---
Passes Ro3:
N
QED Weighted:
0.77
DETAILS
CLOSE
ALA3249316 Name:
(8R,9S,13S,14S,17S)-3-(2-(dimethylamino)ethoxy)-13-methyl-6-phenyl-9,11,12,Show More⌵
Mol. Formula:
C28H36ClNO2
M.W.:
454.05
Type:
Small molecule
AlogP:
5.34
Polar Surface Area:
32.70
HBA:
3
HBD:
1
#RO5 Violations:
1
#Rotatable Bonds:
5
Passes Ro3:
N
QED Weighted:
0.71
DETAILS
CLOSE
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