ALA5198760Name:
2-Hydroxy-5-(4-((4-sulfamoylphenyl)amino)phthalazin-1-yl)benzenesulfonamideMol. Formula:
C20H17N5O5S2M.W.:
471.52Type:
---AlogP:
2.04Polar Surface Area:
178.36HBA:
8HBD:
4#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.34DETAILS
Type:
---AlogP:
2.27Polar Surface Area:
164.37HBA:
8HBD:
4#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.28DETAILS
Type:
---AlogP:
2.93Polar Surface Area:
138.59HBA:
8HBD:
2#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.37DETAILS
ALA5205345Name:
5-(4-(4-chlorophenylamino)phthalazin-1-yl)-2-methylbenzenesulfonamideMol. Formula:
C21H17ClN4O2SM.W.:
424.91Type:
---AlogP:
4.65Polar Surface Area:
97.97HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.50DETAILS
Type:
---AlogP:
4.07Polar Surface Area:
157.28HBA:
8HBD:
3#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.26DETAILS-
Type:
---AlogP:
3.87Polar Surface Area:
157.03HBA:
8HBD:
3#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.26DETAILS -
Type:
---AlogP:
3.25Polar Surface Area:
135.35HBA:
7HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.42DETAILS - ALA5199666
Name:
5-(4-(4-hydroxyphenylamino)phthalazin-1-yl)-2-methylbenzenesulfonamideMol. Formula:
C21H18N4O3SM.W.:
406.47Type:
---AlogP:
3.70Polar Surface Area:
118.20HBA:
6HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.44DETAILS - ALA5208678
Name:
4-(4-(4-methoxyphenyl)phthalazin-1-ylamino)benzenesulfonamideMol. Formula:
C21H18N4O3SM.W.:
406.47Type:
---AlogP:
3.70Polar Surface Area:
107.20HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.52DETAILS -
Type:
---AlogP:
3.92Polar Surface Area:
58.44HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.35DETAILS -
Type:
---AlogP:
3.05Polar Surface Area:
164.37HBA:
8HBD:
4#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.26DETAILS - ALA5194668
Name:
5-(1-(m-tolyloxy)butyl)-1,3,4-oxadiazole-2(3H)-thioneMol. Formula:
C13H16N2O2SM.W.:
264.35Type:
---AlogP:
3.96Polar Surface Area:
51.05HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.83DETAILS - ALA5192465
Name:
2-Methoxy-5-(4-((4-sulfamoylphenyl)amino)phthalazin-1-yl)benzenesulfonamideMol. Formula:
C21H19N5O5S2M.W.:
485.55Type:
---AlogP:
2.34Polar Surface Area:
167.36HBA:
8HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.37DETAILS -
Type:
---AlogP:
5.08Polar Surface Area:
123.75HBA:
8HBD:
2#RO5 Violations:
2#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.33DETAILS - ALA5190049
Name:
4-((4-(p-Tolyl)phthalazin-1-yl)amino)benzenesulfonamideMol. Formula:
C21H18N4O2SM.W.:
390.47Type:
---AlogP:
4.00Polar Surface Area:
97.97HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.55DETAILS - ALA5188097
Name:
2-Methyl-5-{4-[(4-sulfamoylphenyl)amino]phthalazin-1-yl}benzamideMol. Formula:
C22H19N5O3SM.W.:
433.49Type:
---AlogP:
3.10Polar Surface Area:
141.06HBA:
6HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.44DETAILS - ALA5186468
Name:
4-(4-(4-hydroxyphenyl)phthalazin-1-ylamino)benzenesulfonamideMol. Formula:
C20H16N4O3SM.W.:
392.44Type:
---AlogP:
3.39Polar Surface Area:
118.20HBA:
6HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.49DETAILS -
Type:
---AlogP:
4.05Polar Surface Area:
136.89HBA:
8HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.40DETAILS -
Type:
---AlogP:
5.12Polar Surface Area:
110.86HBA:
7HBD:
2#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.37DETAILS - ALA5179873
Name:
2-Chloro-5-(4-((4-sulfamoylphenyl)amino)phthalazin-1-yl)benzenesulfonamideMol. Formula:
C20H16ClN5O4S2M.W.:
489.97Type:
---AlogP:
2.99Polar Surface Area:
158.13HBA:
7HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.39DETAILS
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