ALA4798460Name:
1-[4-(3-tert-Butyl-4-hydroxyphenoxy)-3-chlorophenyl]ethan-1-oneMol. Formula:
C18H19ClO3M.W.:
318.80Type:
UnknownAlogP:
5.34Polar Surface Area:
46.53HBA:
3HBD:
1#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.78DETAILS
ALA4794502Name:
N-{3-Chloro-4-[(4-chloronaphthalen-1-yl)oxy]phenyl}propanamideMol. Formula:
C19H15Cl2NO2M.W.:
360.24Type:
UnknownAlogP:
6.29Polar Surface Area:
38.33HBA:
2HBD:
1#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.59DETAILS
ALA4790878Name:
2-tert-Butyl-4-[(1-methyl-2-phenyl-1H-benzimidazol-6-yl)oxy]phenolMol. Formula:
C24H24N2O2M.W.:
372.47Type:
UnknownAlogP:
6.04Polar Surface Area:
47.28HBA:
4HBD:
1#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.48DETAILS
ALA4789973Name:
2-tert-Butyl-4-{[1-methyl-2-(phenoxymethyl)-1H-benzimidazol-6-yl]oxy}phenolMol. Formula:
C25H26N2O3M.W.:
402.49Type:
UnknownAlogP:
5.95Polar Surface Area:
56.51HBA:
5HBD:
1#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.45DETAILS
ALA4789350Name:
2-tert-Butyl-4-[(1,2-dimethyl-1H-benzimidazol-6-yl)oxy]phenolMol. Formula:
C19H22N2O2M.W.:
310.40Type:
UnknownAlogP:
4.68Polar Surface Area:
47.28HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.75DETAILS- ALA4783029
Name:
N-[4-(3-tert-Butyl-4-hydroxyphenoxy)-3-chlorophenyl]acetamideMol. Formula:
C18H20ClNO3M.W.:
333.82Type:
UnknownAlogP:
5.09Polar Surface Area:
58.56HBA:
3HBD:
2#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.82DETAILS -
Type:
UnknownAlogP:
5.84Polar Surface Area:
102.68HBA:
8HBD:
2#RO5 Violations:
2#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.31DETAILS - ALA4761252
Name:
6-(3-tert-Butylphenoxy)-1-methyl-2-(phenoxymethyl)-1H-benzimidazoleMol. Formula:
C25H26N2O2M.W.:
386.50Type:
UnknownAlogP:
6.24Polar Surface Area:
36.28HBA:
4HBD:
---#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.41DETAILS - ALA4760865
Name:
1-[4-(3-tert-Butyl-4-hydroxyphenoxy)phenyl]ethan-1-oneMol. Formula:
C18H20O3M.W.:
284.36Type:
UnknownAlogP:
4.68Polar Surface Area:
46.53HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.83DETAILS - ALA4756874
Name:
N-{3-Chloro-4-[(naphthalen-1-yl)oxy]phenyl}acetamideMol. Formula:
C18H14ClNO2M.W.:
311.77Type:
UnknownAlogP:
5.24Polar Surface Area:
38.33HBA:
2HBD:
1#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.72DETAILS - ALA4751434
Name:
N-{3-Chloro-4-[(4-chloronaphthalen-1-yl)oxy]phenyl}acetamideMol. Formula:
C18H13Cl2NO2M.W.:
346.21Type:
UnknownAlogP:
5.90Polar Surface Area:
38.33HBA:
2HBD:
1#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.64DETAILS - ALA4744735
Name:
N-{3-Chloro-4-[(4-chloronaphthalen-1-yl)oxy]phenyl}butanamideMol. Formula:
C20H17Cl2NO2M.W.:
374.27Type:
UnknownAlogP:
6.68Polar Surface Area:
38.33HBA:
2HBD:
1#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.54DETAILS - ALA4742675
Name:
N-{4-[(4-Chloronaphthalen-1-yl)oxy]phenyl}acetamideMol. Formula:
C18H14ClNO2M.W.:
311.77Type:
UnknownAlogP:
5.24Polar Surface Area:
38.33HBA:
2HBD:
1#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.72DETAILS -
Type:
UnknownAlogP:
5.59Polar Surface Area:
35.50HBA:
3HBD:
2#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.44DETAILS -
Type:
UnknownAlogP:
4.98Polar Surface Area:
80.58HBA:
5HBD:
1#RO5 Violations:
1#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.23DETAILS -
Type:
UnknownAlogP:
7.75Polar Surface Area:
182.98HBA:
10HBD:
4#RO5 Violations:
2#Rotatable Bonds:
17Passes Ro3:
NQED Weighted:
0.04DETAILS -
Type:
UnknownAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS -
Type:
UnknownAlogP:
6.71Polar Surface Area:
26.71HBA:
3HBD:
1#RO5 Violations:
2#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.34DETAILS -
Type:
UnknownAlogP:
6.98Polar Surface Area:
192.21HBA:
11HBD:
4#RO5 Violations:
3#Rotatable Bonds:
18Passes Ro3:
NQED Weighted:
0.04DETAILS -
Type:
UnknownAlogP:
4.70Polar Surface Area:
85.34HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.40DETAILS
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