ALA4579257Name:
2,4-dimethoxy-6-(2-(naphthalen-2-yl)ethyl)benzoic acidMol. Formula:
C21H20O4M.W.:
336.39Type:
UnknownAlogP:
4.34Polar Surface Area:
55.76HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.73DETAILS
Type:
UnknownAlogP:
2.67Polar Surface Area:
70.67HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.59DETAILS
Type:
UnknownAlogP:
4.74Polar Surface Area:
46.53HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.68DETAILS
ALA4518952Name:
1-(2,4-dihydroxyphenyl)-2-(naphthalen-2-yloxy)ethanoneMol. Formula:
C18H14O4M.W.:
294.31Type:
UnknownAlogP:
3.51Polar Surface Area:
66.76HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.72DETAILS
ALA4475580Name:
(E)-2-(2-(3,4,5-trimethoxycyclohexa-1,3-dien-1-yl)vinyl)naphthaleneMol. Formula:
C21H22O3M.W.:
322.40Type:
UnknownAlogP:
4.70Polar Surface Area:
27.69HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.80DETAILS- ALA4472154
Name:
(E)-4-chloro-2-hydroxy-6-(2-(naphthalen-2-yl)vinyl)benzoic acidMol. Formula:
C19H13ClO3M.W.:
324.76Type:
UnknownAlogP:
5.07Polar Surface Area:
57.53HBA:
2HBD:
2#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.66DETAILS -
Type:
UnknownAlogP:
2.85Polar Surface Area:
66.76HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.79DETAILS - ALA4459260
Name:
(E)-5-(2,4-dihydroxybenzylidene)-2-(pyrrolidin-1-yl)thiazol-4(5H)-oneMol. Formula:
C14H14N2O3SM.W.:
290.34Type:
UnknownAlogP:
2.16Polar Surface Area:
73.13HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.78DETAILS - ALA4457123
Name:
1-(2,4-dihydroxyphenyl)-2-(4-methoxyphenoxy)ethanoneMol. Formula:
C15H14O5M.W.:
274.27Type:
UnknownAlogP:
2.37Polar Surface Area:
75.99HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.82DETAILS - ALA4452673
Name:
(E)-2,4-dimethoxy-6-(2-(naphthalen-2-yl)vinyl)benzoic acidMol. Formula:
C21H18O4M.W.:
334.37Type:
UnknownAlogP:
4.73Polar Surface Area:
55.76HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.69DETAILS -
Type:
UnknownAlogP:
5.16Polar Surface Area:
57.53HBA:
2HBD:
2#RO5 Violations:
1#Rotatable Bonds:
11Passes Ro3:
NQED Weighted:
0.55DETAILS - ALA4450783
Name:
(E)-2-methoxy-4-methyl-6-(2-(naphthalen-2-yl)vinyl)benzoic acidMol. Formula:
C21H18O3M.W.:
318.37Type:
UnknownAlogP:
5.03Polar Surface Area:
46.53HBA:
2HBD:
1#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.69DETAILS - ALA4449537
Name:
(E)-2-hydroxy-4-methyl-6-(2-(naphthalen-2-yl)vinyl)benzoic acidMol. Formula:
C20H16O3M.W.:
304.35Type:
UnknownAlogP:
4.72Polar Surface Area:
57.53HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.69DETAILS - ALA4435033
Name:
(E)-4-chloro-2-methoxy-6-(2-(naphthalen-2-yl)vinyl)benzoic acidMol. Formula:
C20H15ClO3M.W.:
338.79Type:
UnknownAlogP:
5.37Polar Surface Area:
46.53HBA:
2HBD:
1#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.65DETAILS
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