Type:
---AlogP:
4.22Polar Surface Area:
101.06HBA:
7HBD:
3#RO5 Violations:
---#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.58DETAILS
Type:
---AlogP:
5.24Polar Surface Area:
135.20HBA:
9HBD:
3#RO5 Violations:
2#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.29DETAILS
Type:
---AlogP:
3.74Polar Surface Area:
118.13HBA:
8HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.61DETAILS
ALA5200415Name:
tert-Butyl (4-((4-Acetamidophenyl)amino)-1,3,5-triazin-2-yl)-D-leucinateMol. Formula:
C21H30N6O3M.W.:
414.51Type:
---AlogP:
3.74Polar Surface Area:
118.13HBA:
8HBD:
3#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.56DETAILS
Type:
---AlogP:
4.98Polar Surface Area:
135.20HBA:
9HBD:
3#RO5 Violations:
1#Rotatable Bonds:
12Passes Ro3:
NQED Weighted:
0.33DETAILS-
Type:
---AlogP:
2.39Polar Surface Area:
112.06HBA:
7HBD:
4#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.58DETAILS -
Type:
---AlogP:
4.33Polar Surface Area:
135.20HBA:
9HBD:
3#RO5 Violations:
---#Rotatable Bonds:
12Passes Ro3:
NQED Weighted:
0.37DETAILS -
Type:
---AlogP:
4.19Polar Surface Area:
118.13HBA:
8HBD:
3#RO5 Violations:
---#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.41DETAILS -
Type:
---AlogP:
4.40Polar Surface Area:
118.13HBA:
8HBD:
3#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.51DETAILS -
Type:
---AlogP:
2.42Polar Surface Area:
121.37HBA:
8HBD:
3#RO5 Violations:
---#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.55DETAILS - ALA5178415
Name:
Cyclopentyl (4-((4-Acetamidophenyl)amino)-1,3,5-triazin-2-yl)-L-leucinateMol. Formula:
C22H30N6O3M.W.:
426.52Type:
---AlogP:
3.89Polar Surface Area:
118.13HBA:
8HBD:
3#RO5 Violations:
---#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.52DETAILS - ALA5177719
Name:
tert-Butyl (4-((4-Acetamidophenyl)amino)-1,3,5-triazin-2-yl)glycinateMol. Formula:
C17H22N6O3M.W.:
358.40Type:
---AlogP:
2.33Polar Surface Area:
118.13HBA:
8HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.67DETAILS - ALA5175209
Name:
(4-((4-Acetamidophenyl)amino)-1,3,5-triazin-2-yl)-L-phenylalanineMol. Formula:
C20H20N6O3M.W.:
392.42Type:
---AlogP:
2.68Polar Surface Area:
129.13HBA:
7HBD:
4#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.46DETAILS - ALA5175010
Name:
Isopropyl (4-((4-Acetamidophenyl)amino)-1,3,5-triazin-2-yl)-L-leucinateMol. Formula:
C20H28N6O3M.W.:
400.48Type:
---AlogP:
3.35Polar Surface Area:
118.13HBA:
8HBD:
3#RO5 Violations:
---#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.55DETAILS - ALA5174208
Name:
tert-Butyl (4-((4-Acetamidophenyl)amino)-1,3,5-triazin-2-yl)-L-tyrosinateMol. Formula:
C24H28N6O4M.W.:
464.53Type:
---AlogP:
3.64Polar Surface Area:
138.36HBA:
9HBD:
4#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.37DETAILS - ALA5174129
Name:
tert-Butyl (4-((4-Acetamidophenyl)amino)-1,3,5-triazin-2-yl)-L-valinateMol. Formula:
C20H28N6O3M.W.:
400.48Type:
---AlogP:
3.35Polar Surface Area:
118.13HBA:
8HBD:
3#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.61DETAILS -
Type:
---AlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS -
Type:
---AlogP:
4.28Polar Surface Area:
118.13HBA:
8HBD:
3#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.55DETAILS -
Type:
---AlogP:
3.11Polar Surface Area:
118.13HBA:
8HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.65DETAILS - ALA4082715
Name:
Arg-Ser-Ser-Cys-Phe-Gly-Gly-Arg-Ile-Asp-Arg-Ile-Gly-Ala-CysMol. Formula:
C64H108N24O20S2M.W.:
1597.85Type:
Small moleculeAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
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