Type:
---AlogP:
3.51Polar Surface Area:
45.69HBA:
1HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.56DETAILS
Type:
---AlogP:
4.12Polar Surface Area:
72.18HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.57DETAILS
Type:
---AlogP:
2.80Polar Surface Area:
58.97HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
YQED Weighted:
0.81DETAILS
Type:
---AlogP:
3.66Polar Surface Area:
84.22HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
17Passes Ro3:
NQED Weighted:
0.35DETAILS
Type:
---AlogP:
4.66Polar Surface Area:
75.42HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.49DETAILS- ALA5196836
Name:
5-((4-((2-carboxyethyl)carbamoyl)phenyl)sulfonamido)-2-hydroxybenzoic acidMol. Formula:
C17H16N2O8SM.W.:
408.39Type:
---AlogP:
1.10Polar Surface Area:
170.10HBA:
6HBD:
5#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.40DETAILS - ALA5196677
Name:
3-(4-((3-carbamoyl-4-hydroxyphenyl)diazenyl)benzamido)propanoic acidMol. Formula:
C17H16N4O5M.W.:
356.34Type:
---AlogP:
2.11Polar Surface Area:
154.44HBA:
6HBD:
4#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.56DETAILS -
Type:
---AlogP:
-3.05Polar Surface Area:
324.05HBA:
17HBD:
8#RO5 Violations:
3#Rotatable Bonds:
11Passes Ro3:
NQED Weighted:
0.07DETAILS -
Type:
---AlogP:
1.86Polar Surface Area:
127.17HBA:
5HBD:
4#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.60DETAILS -
Type:
---AlogP:
-1.70Polar Surface Area:
346.79HBA:
17HBD:
7#RO5 Violations:
3#Rotatable Bonds:
12Passes Ro3:
NQED Weighted:
0.04DETAILS -
Type:
---AlogP:
-2.79Polar Surface Area:
390.28HBA:
12HBD:
15#RO5 Violations:
3#Rotatable Bonds:
17Passes Ro3:
NQED Weighted:
0.03DETAILS -
Type:
UnknownAlogP:
5.24Polar Surface Area:
171.82HBA:
9HBD:
7#RO5 Violations:
3#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.16DETAILS -
Type:
UnknownAlogP:
4.94Polar Surface Area:
192.05HBA:
10HBD:
8#RO5 Violations:
2#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.12DETAILS -
Type:
UnknownAlogP:
4.43Polar Surface Area:
167.91HBA:
9HBD:
7#RO5 Violations:
2#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.19DETAILS -
Type:
UnknownAlogP:
4.14Polar Surface Area:
188.14HBA:
10HBD:
8#RO5 Violations:
2#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.14DETAILS -
Type:
UnknownAlogP:
5.24Polar Surface Area:
171.82HBA:
9HBD:
7#RO5 Violations:
3#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.16DETAILS - ALA4879347
Name:
4-(pyridin-2-ylmethyl)-3,4-dihydro-2H-benzo[b][1,4]oxazine-2-carboxamideMol. Formula:
C15H15N3O2M.W.:
269.30Type:
UnknownAlogP:
1.33Polar Surface Area:
68.45HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.91DETAILS - ALA4878754
Name:
N4-p-tolyl-2H-benzo[b][1,4]oxazine-2,4(3H)-dicarboxamideMol. Formula:
C17H17N3O3M.W.:
311.34Type:
UnknownAlogP:
2.28Polar Surface Area:
84.66HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.89DETAILS -
Type:
UnknownAlogP:
2.74Polar Surface Area:
106.78HBA:
7HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.83DETAILS - ALA4876979
Name:
4-(2-hydroxybenzyl)-3,4-dihydro-2H-benzo[b][1,4]oxazine-2-carboxamideMol. Formula:
C16H16N2O3M.W.:
284.31Type:
UnknownAlogP:
1.65Polar Surface Area:
75.79HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.90DETAILS
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