Type:
UnknownAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
Type:
UnknownAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
ALA4797406Name:
5,8-dihydroxy-4,4-dimethyl-2-pentylnaphthalen-1(4H)-oneMol. Formula:
C17H22O3M.W.:
274.36Type:
UnknownAlogP:
4.08Polar Surface Area:
57.53HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.64DETAILS
ALA4795847Name:
5',8'-dihydroxy-4'H-spiro[cyclopentane-1,1'-naphthalen]-4'-oneMol. Formula:
C14H14O3M.W.:
230.26Type:
UnknownAlogP:
2.66Polar Surface Area:
57.53HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
YQED Weighted:
0.67DETAILS
Type:
UnknownAlogP:
5.01Polar Surface Area:
83.83HBA:
5HBD:
2#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.42DETAILS- ALA4793216
Name:
5,8-dihydroxy-4,4-dimethyl-2-hexylnaphthalen-1(4H)-oneMol. Formula:
C18H24O3M.W.:
288.39Type:
UnknownAlogP:
4.47Polar Surface Area:
57.53HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.62DETAILS - ALA4786818
Name:
5,8-dihydroxy-4,4,6,7-tetramethylnaphthalen-1(4H)-oneMol. Formula:
C14H16O3M.W.:
232.28Type:
UnknownAlogP:
2.74Polar Surface Area:
57.53HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
YQED Weighted:
0.68DETAILS - ALA4781450
Name:
5,8-dihydroxy-4,4-dimethyl-2-heptylnaphthalen-1(4H)-oneMol. Formula:
C19H26O3M.W.:
302.41Type:
UnknownAlogP:
4.86Polar Surface Area:
57.53HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.58DETAILS -
Type:
UnknownAlogP:
5.01Polar Surface Area:
83.83HBA:
5HBD:
2#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.42DETAILS - ALA4780580
Name:
4,4-diethyl-9,10-dihydroxy-5,8-dihydroanthracen-1(4H)-oneMol. Formula:
C18H20O3M.W.:
284.36Type:
UnknownAlogP:
3.56Polar Surface Area:
57.53HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.64DETAILS -
Type:
UnknownAlogP:
2.91Polar Surface Area:
57.53HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
YQED Weighted:
0.77DETAILS - ALA4776370
Name:
9,10-dihydroxy-5,8-dihydro-4H-spiro[anthracene-1,1'-cyclopentan]-4-oneMol. Formula:
C18H18O3M.W.:
282.34Type:
UnknownAlogP:
3.32Polar Surface Area:
57.53HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.57DETAILS - ALA4588877
Name:
N-(4-hydroxyphenethyl)-3-(3,4,5-trimethoxyphenyl)acrylamideMol. Formula:
C20H23NO5M.W.:
357.41Type:
UnknownAlogP:
2.79Polar Surface Area:
77.02HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.71DETAILS - ALA4552392
Name:
1-(3,5-dimethylpiperidin-1-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-oneMol. Formula:
C19H27NO4M.W.:
333.43Type:
UnknownAlogP:
3.23Polar Surface Area:
48.00HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.78DETAILS - ALA4442837
Name:
N-(4-methoxyphenethyl)-3-(3,4,5-trimethoxyphenyl)acrylamideMol. Formula:
C21H25NO5M.W.:
371.43Type:
UnknownAlogP:
3.09Polar Surface Area:
66.02HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.69DETAILS -
Type:
Small moleculeAlogP:
3.70Polar Surface Area:
72.70HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.48DETAILS -
Type:
Small moleculeAlogP:
3.70Polar Surface Area:
72.70HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.48DETAILS -
Type:
Small moleculeAlogP:
3.66Polar Surface Area:
72.70HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.52DETAILS -
Type:
Small moleculeAlogP:
3.70Polar Surface Area:
72.70HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.48DETAILS -
Type:
Small moleculeAlogP:
5.52Polar Surface Area:
117.36HBA:
7HBD:
1#RO5 Violations:
2#Rotatable Bonds:
14Passes Ro3:
NQED Weighted:
0.17DETAILS
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