ALA4591523Name:
N-[(3-methoxyphenyl)methyl]-4-phenylphthalazin-1-amineMol. Formula:
C22H19N3OM.W.:
341.41Type:
UnknownAlogP:
4.92Polar Surface Area:
47.04HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.56DETAILS
ALA4589945Name:
N-[(2-methoxyphenyl)methyl]-4-phenylphthalazin-1-amineMol. Formula:
C22H19N3OM.W.:
341.41Type:
UnknownAlogP:
4.92Polar Surface Area:
47.04HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.56DETAILS
Type:
UnknownAlogP:
5.06Polar Surface Area:
51.97HBA:
5HBD:
1#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.51DETAILS
ALA4586085Name:
N-[(4-Hydroxyphenyl)methyl]-3-(trifluoromethyl)benzamideMol. Formula:
C15H12F3NO2M.W.:
295.26Type:
UnknownAlogP:
3.34Polar Surface Area:
49.33HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.91DETAILS
Type:
UnknownAlogP:
4.91Polar Surface Area:
37.81HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.58DETAILS- ALA4579954
Name:
N-(4-methoxybenzyl)-N-methyl-3-(trifluoromethyl)benzamideMol. Formula:
C17H16F3NO2M.W.:
323.31Type:
UnknownAlogP:
3.99Polar Surface Area:
29.54HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.85DETAILS - ALA4572825
Name:
5-Chloro-1-cyclopentyl-N-[(4-methoxyphenyl)methyl]-1H-indazol-3-amineMol. Formula:
C20H22ClN3OM.W.:
355.87Type:
UnknownAlogP:
5.43Polar Surface Area:
39.08HBA:
4HBD:
1#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.66DETAILS - ALA4570903
Name:
N-[(3-Methoxyphenyl)methyl]-3-(trifluoromethyl)benzamideMol. Formula:
C16H14F3NO2M.W.:
309.29Type:
UnknownAlogP:
3.64Polar Surface Area:
38.33HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.94DETAILS - ALA4566048
Name:
4-Chloro-N-[(4-methoxyphenyl)methyl]-7-(trifluoromethyl)phthalazin-1-amineMol. Formula:
C17H13ClF3N3OM.W.:
367.76Type:
UnknownAlogP:
4.92Polar Surface Area:
47.04HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.71DETAILS - ALA4565771
Name:
1-(4-{[(4-Methoxyphenyl)methyl]amino}phtalazin-1-yl)piperidin-4-olMol. Formula:
C21H24N4O2M.W.:
364.45Type:
UnknownAlogP:
3.21Polar Surface Area:
70.51HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.72DETAILS - ALA4563939
Name:
N-[(4-Butoxyphenyl)methyl]-3-(trifluoromethyl)benzamideMol. Formula:
C19H20F3NO2M.W.:
351.37Type:
UnknownAlogP:
4.81Polar Surface Area:
38.33HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.73DETAILS -
Type:
UnknownAlogP:
2.63Polar Surface Area:
38.33HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.89DETAILS - ALA4561469
Name:
N-[2-(2-Chlorophenyl)ethyl]-3-(trifluoromethyl)benzamideMol. Formula:
C16H13ClF3NOM.W.:
327.73Type:
UnknownAlogP:
4.33Polar Surface Area:
29.10HBA:
1HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.89DETAILS - ALA4556746
Name:
1-Cyclopentyl-N-[(4-methoxyphenyl)methyl]-1H-indazol-3-amineMol. Formula:
C20H23N3OM.W.:
321.42Type:
UnknownAlogP:
4.77Polar Surface Area:
39.08HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.74DETAILS - ALA4555616
Name:
N-(3-chlorophenyl)-4-(piperidin-1-yl)phthalazin-1-amineMol. Formula:
C19H19ClN4M.W.:
338.84Type:
UnknownAlogP:
5.02Polar Surface Area:
41.05HBA:
4HBD:
1#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.73DETAILS - ALA4551244
Name:
N-[(4-methoxyphenyl)methyl]-4-(4-methylpiperazin-1-yl)phthalazin-1-amineMol. Formula:
C21H25N5OM.W.:
363.47Type:
UnknownAlogP:
3.00Polar Surface Area:
53.52HBA:
6HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.75DETAILS - ALA4550002
Name:
2-(4-methoxybenzyl)-1-methyl-5-(trifluoromethyl)-1H-indazol-3(2H)-oneMol. Formula:
C17H15F3N2O2M.W.:
336.31Type:
UnknownAlogP:
3.42Polar Surface Area:
36.16HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.73DETAILS - ALA4549948
Name:
N-[2-(3-chlorophenyl)ethyl-4-phenylphthalazin-1-amineMol. Formula:
C22H18ClN3M.W.:
359.86Type:
UnknownAlogP:
5.60Polar Surface Area:
37.81HBA:
3HBD:
1#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.50DETAILS - ALA4549682
Name:
3,4-Dichloro-N-[(4-methoxyphenyl)methyl]benzamideMol. Formula:
C15H13Cl2NO2M.W.:
310.18Type:
UnknownAlogP:
3.93Polar Surface Area:
38.33HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.93DETAILS -
Type:
UnknownAlogP:
3.18Polar Surface Area:
49.94HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.75DETAILS
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