ALA5280998Name:
2-cyano-3-(4-(2-hydroxyethoxy)phenyl)acrylic acidMol. Formula:
C12H11NO4M.W.:
233.22Type:
---AlogP:
1.05Polar Surface Area:
90.55HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.59DETAILS
Type:
---AlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
Type:
---AlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
Type:
Small moleculeAlogP:
4.88Polar Surface Area:
64.33HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.48DETAILS
Type:
Small moleculeAlogP:
1.56Polar Surface Area:
70.75HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.68DETAILS-
Type:
Small moleculeAlogP:
2.67Polar Surface Area:
70.75HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.65DETAILS -
Type:
Small moleculeAlogP:
3.12Polar Surface Area:
70.75HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.83DETAILS -
Type:
Small moleculeAlogP:
4.98Polar Surface Area:
70.75HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.45DETAILS -
Type:
---AlogP:
3.02Polar Surface Area:
78.91HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.59DETAILS - ALA5268352
Name:
3-(4-(2-bromoethoxy)phenyl)-2-cyanoacrylic acidMol. Formula:
C12H10BrNO3M.W.:
296.12Type:
---AlogP:
2.45Polar Surface Area:
70.32HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.51DETAILS -
Type:
---AlogP:
1.10Polar Surface Area:
122.45HBA:
9HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.59DETAILS - ALA5220706
Name:
(E)-2-cyano-3-(4-isopropylphenyl)prop-2-enoic acidMol. Formula:
C13H13NO2M.W.:
215.25Type:
---AlogP:
2.80Polar Surface Area:
61.09HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.62DETAILS -
Type:
Small moleculeAlogP:
6.00Polar Surface Area:
70.75HBA:
4HBD:
1#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.36DETAILS -
Type:
Small moleculeAlogP:
1.76Polar Surface Area:
73.56HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.49DETAILS -
Type:
Small moleculeAlogP:
4.16Polar Surface Area:
107.67HBA:
8HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.41DETAILS -
Type:
Small moleculeAlogP:
4.89Polar Surface Area:
73.56HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.43DETAILS -
Type:
Small moleculeAlogP:
2.29Polar Surface Area:
73.56HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.67DETAILS -
Type:
Small moleculeAlogP:
2.87Polar Surface Area:
73.56HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.45DETAILS -
Type:
Small moleculeAlogP:
5.16Polar Surface Area:
73.56HBA:
4HBD:
1#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.48DETAILS -
Type:
Small moleculeAlogP:
4.87Polar Surface Area:
73.56HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
12Passes Ro3:
NQED Weighted:
0.33DETAILS
The page will load shortly, Thanks for your patience!
Select all
