Type:
Small moleculeAlogP:
5.50Polar Surface Area:
68.90HBA:
5HBD:
1#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.42DETAILS
Type:
Small moleculeAlogP:
3.14Polar Surface Area:
68.90HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.84DETAILS
Type:
Small moleculeAlogP:
4.15Polar Surface Area:
89.13HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.51DETAILS
Type:
Small moleculeAlogP:
4.83Polar Surface Area:
78.13HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.60DETAILS
ALA203540Name:
4-((5-acetyl-6-hydroxy-4-methoxybenzofuran-7-yloxy)methyl)benzoic acidMol. Formula:
C19H16O7M.W.:
356.33Type:
Small moleculeAlogP:
3.63Polar Surface Area:
106.20HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.65DETAILS- ALA203647
Name:
1-(7-(3-nitrobenzyloxy)-6-hydroxy-4-methoxybenzofuran-5-yl)ethanoneMol. Formula:
C18H15NO7M.W.:
357.32Type:
Small moleculeAlogP:
3.84Polar Surface Area:
112.04HBA:
7HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.41DETAILS - ALA203646
Name:
3-((5-acetyl-6-hydroxy-4-methoxybenzofuran-7-yloxy)methyl)benzoic acidMol. Formula:
C19H16O7M.W.:
356.33Type:
Small moleculeAlogP:
3.63Polar Surface Area:
106.20HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.65DETAILS - ALA383465
Name:
1-[6-Hydroxy-4-methoxy-7-(3-methyl-benzyloxy)-benzofuran-5-yl]-ethanoneMol. Formula:
C19H18O5M.W.:
326.35Type:
Small moleculeAlogP:
4.24Polar Surface Area:
68.90HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.71DETAILS - ALA203852
Name:
1-(7-(3-chlorobenzyloxy)-6-hydroxy-4-methoxybenzofuran-5-yl)ethanoneMol. Formula:
C18H15ClO5M.W.:
346.77Type:
Small moleculeAlogP:
4.58Polar Surface Area:
68.90HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.68DETAILS -
Type:
Small moleculeAlogP:
5.60Polar Surface Area:
68.90HBA:
5HBD:
1#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.44DETAILS - ALA381476
Name:
1-(4-(4-tert-butylbenzyloxy)-6-hydroxy-7-methoxybenzofuran-5-yl)ethanoneMol. Formula:
C22H24O5M.W.:
368.43Type:
Small moleculeAlogP:
5.23Polar Surface Area:
68.90HBA:
5HBD:
1#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.62DETAILS - ALA204088
Name:
1-(7-(3-fluorobenzyloxy)-6-hydroxy-4-methoxybenzofuran-5-yl)ethanoneMol. Formula:
C18H15FO5M.W.:
330.31Type:
Small moleculeAlogP:
4.07Polar Surface Area:
68.90HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.71DETAILS - ALA380826
Name:
1-[7-(Biphenyl-2-ylmethoxy)-6-hydroxy-4-methoxy-benzofuran-5-yl]-ethanoneMol. Formula:
C24H20O5M.W.:
388.42Type:
Small moleculeAlogP:
5.60Polar Surface Area:
68.90HBA:
5HBD:
1#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.44DETAILS - ALA204695
Name:
1-(4-(4-isopropylbenzyloxy)-6-hydroxy-7-methoxybenzofuran-5-yl)ethanoneMol. Formula:
C21H22O5M.W.:
354.40Type:
Small moleculeAlogP:
5.05Polar Surface Area:
68.90HBA:
5HBD:
1#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.63DETAILS -
Type:
Small moleculeAlogP:
4.95Polar Surface Area:
68.90HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.63DETAILS - ALA204803
Name:
1-{6-hydroxy-7-methoxy-4-[(2-methylbenzyl)oxy]-1-benzofuran-5-yl}ethanoneMol. Formula:
C19H18O5M.W.:
326.35Type:
Small moleculeAlogP:
4.24Polar Surface Area:
68.90HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.71DETAILS - ALA379468
Name:
1-(4-(2-chlorobenzyloxy)-6-hydroxy-7-methoxybenzofuran-5-yl)ethanoneMol. Formula:
C18H15ClO5M.W.:
346.77Type:
Small moleculeAlogP:
4.58Polar Surface Area:
68.90HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.68DETAILS - ALA204256
Name:
1-(4-(2-fluorobenzyloxy)-6-hydroxy-7-methoxybenzofuran-5-yl)ethanoneMol. Formula:
C18H15FO5M.W.:
330.31Type:
Small moleculeAlogP:
4.07Polar Surface Area:
68.90HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.71DETAILS - ALA204255
Name:
1-(6-hydroxy-7-methoxy-4-(naphthalen-2-ylmethoxy)benzofuran-5-yl)ethanoneMol. Formula:
C22H18O5M.W.:
362.38Type:
Small moleculeAlogP:
5.08Polar Surface Area:
68.90HBA:
5HBD:
1#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.50DETAILS - ALA203798
Name:
1-(4-(benzyloxy)-6-hydroxy-7-methoxybenzofuran-5-yl)ethanoneMol. Formula:
C18H16O5M.W.:
312.32Type:
Small moleculeAlogP:
3.93Polar Surface Area:
68.90HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.72DETAILS
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