ALA4796038Name:
N-(cyclopropylmethyl)-3-(3-fluoro-4-methoxybenzylamino)benzamideMol. Formula:
C19H21FN2O2M.W.:
328.39Type:
UnknownAlogP:
3.59Polar Surface Area:
50.36HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.82DETAILS
Type:
UnknownAlogP:
4.59Polar Surface Area:
62.83HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.61DETAILS
Type:
UnknownAlogP:
4.20Polar Surface Area:
62.83HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.64DETAILS
ALA4791263Name:
N-(benzo[d][1,3]dioxol-5-ylmethyl)-3,4-dichloroanilineMol. Formula:
C14H11Cl2NO2M.W.:
296.15Type:
UnknownAlogP:
4.33Polar Surface Area:
30.49HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.91DETAILS
Type:
UnknownAlogP:
3.55Polar Surface Area:
73.83HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.60DETAILS- ALA4785463
Name:
N-(cyclopropylmethyl)-5-(3-fluoro-4-methoxybenzamido)-2-morpholinobenzamideMol. Formula:
C23H26FN3O4M.W.:
427.48Type:
UnknownAlogP:
3.06Polar Surface Area:
79.90HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.71DETAILS - ALA4785151
Name:
5-(benzo[d][1,3]dioxol-5-ylmethylamino)-2-chlorobenzoic acidMol. Formula:
C15H12ClNO4M.W.:
305.72Type:
UnknownAlogP:
3.38Polar Surface Area:
67.79HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.91DETAILS - ALA4780679
Name:
5-(3,4-dichlorobenzylamino)-2-morpholinobenzoic acidMol. Formula:
C18H18Cl2N2O3M.W.:
381.26Type:
UnknownAlogP:
4.14Polar Surface Area:
61.80HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.82DETAILS -
Type:
UnknownAlogP:
3.81Polar Surface Area:
62.83HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.67DETAILS -
Type:
UnknownAlogP:
3.45Polar Surface Area:
54.04HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.70DETAILS - ALA4777417
Name:
5-((3-fluoro-4-methoxybenzyl)amino)-2-morpholino-N-neopentylbenzamideMol. Formula:
C24H32FN3O3M.W.:
429.54Type:
UnknownAlogP:
4.06Polar Surface Area:
62.83HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.70DETAILS - ALA4776275
Name:
5-((3-fluoro-4-methoxybenzyl)amino)-N-isobutyl-2-morpholinobenzamideMol. Formula:
C23H30FN3O3M.W.:
415.51Type:
UnknownAlogP:
3.67Polar Surface Area:
62.83HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.69DETAILS -
Type:
UnknownAlogP:
3.76Polar Surface Area:
62.83HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.66DETAILS -
Type:
UnknownAlogP:
2.72Polar Surface Area:
91.34HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.61DETAILS -
Type:
UnknownAlogP:
4.58Polar Surface Area:
53.60HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.67DETAILS - ALA4763451
Name:
N-(benzo[d][1,3]dioxol-5-ylmethyl)-4-fluoroanilineMol. Formula:
C14H12FNO2M.W.:
245.25Type:
UnknownAlogP:
3.17Polar Surface Area:
30.49HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.90DETAILS - ALA4763183
Name:
5-((3-fluoro-4-methoxybenzyl)amino)-2-morpholino-N-propylbenzamideMol. Formula:
C22H28FN3O3M.W.:
401.48Type:
UnknownAlogP:
3.42Polar Surface Area:
62.83HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.71DETAILS -
Type:
UnknownAlogP:
3.91Polar Surface Area:
54.04HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.76DETAILS - ALA4762835
Name:
N-cyclopropyl-5-((3-fluoro-4-methoxybenzyl)amino)-2-morpholinobenzamideMol. Formula:
C22H26FN3O3M.W.:
399.47Type:
UnknownAlogP:
3.18Polar Surface Area:
62.83HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.75DETAILS - ALA4761870
Name:
2-(2-chlorophenyl)-2-oxoethyl 4-(4-chlorophenylamino)-4-oxobutanoateMol. Formula:
C18H15Cl2NO4M.W.:
380.23Type:
UnknownAlogP:
4.14Polar Surface Area:
72.47HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.58DETAILS
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