Type:
---AlogP:
5.32Polar Surface Area:
102.98HBA:
5HBD:
1#RO5 Violations:
1#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.38DETAILS
Type:
---AlogP:
1.89Polar Surface Area:
155.51HBA:
9HBD:
3#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.29DETAILS
Type:
---AlogP:
5.09Polar Surface Area:
48.13HBA:
2HBD:
2#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.63DETAILS
Type:
---AlogP:
4.50Polar Surface Area:
115.38HBA:
8HBD:
---#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.17DETAILS
ALA5281464Name:
5-chloro-3-methyl-N-(4-morpholinophenethyl)-1H-indole-2-carboxamideMol. Formula:
C22H24ClN3O2M.W.:
397.91Type:
---AlogP:
3.94Polar Surface Area:
57.36HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.69DETAILS-
Type:
---AlogP:
3.26Polar Surface Area:
79.18HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.50DETAILS -
Type:
---AlogP:
2.09Polar Surface Area:
79.18HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.51DETAILS - ALA5280144
Name:
6-fluoro-N-(4-fluorophenethyl)-3-methyl-1H-indole-2-carboxamideMol. Formula:
C18H16F2N2OM.W.:
314.33Type:
---AlogP:
3.73Polar Surface Area:
44.89HBA:
1HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.76DETAILS -
Type:
---AlogP:
2.22Polar Surface Area:
137.22HBA:
7HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.64DETAILS - ALA5275225
Name:
1-benzoyl-3-(4-fluorophenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dioneMol. Formula:
C17H11FN2O3SM.W.:
342.35Type:
---AlogP:
2.52Polar Surface Area:
57.69HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.48DETAILS -
Type:
---AlogP:
3.66Polar Surface Area:
80.05HBA:
7HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.77DETAILS -
Type:
---AlogP:
2.21Polar Surface Area:
122.72HBA:
8HBD:
3#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.66DETAILS -
Type:
---AlogP:
5.37Polar Surface Area:
166.83HBA:
9HBD:
3#RO5 Violations:
2#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.20DETAILS -
Type:
---AlogP:
5.57Polar Surface Area:
167.08HBA:
9HBD:
3#RO5 Violations:
2#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.20DETAILS -
Type:
---AlogP:
3.99Polar Surface Area:
110.99HBA:
7HBD:
4#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.53DETAILS -
Type:
---AlogP:
3.79Polar Surface Area:
136.69HBA:
7HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.32DETAILS -
Type:
---AlogP:
4.74Polar Surface Area:
116.46HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.33DETAILS - ALA5209307
Name:
(S)-2-(4-acetamidophenyl)-N-(5-propylthiazol-2-yl)propanamideMol. Formula:
C17H21N3O2SM.W.:
331.44Type:
---AlogP:
3.80Polar Surface Area:
71.09HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.85DETAILS -
Type:
---AlogP:
1.49Polar Surface Area:
158.66HBA:
8HBD:
4#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.40DETAILS -
Type:
---AlogP:
3.79Polar Surface Area:
153.76HBA:
7HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.29DETAILS
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