ALA3961335Name:
2-allyl-N-((4,5-dihydro-1H-imidazol-2-yl)methyl)anilineMol. Formula:
C13H17N3M.W.:
215.30Type:
Small moleculeAlogP:
1.83Polar Surface Area:
36.42HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.74DETAILS
Type:
Small moleculeAlogP:
2.43Polar Surface Area:
24.39HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.76DETAILS
Type:
Small moleculeAlogP:
2.35Polar Surface Area:
24.39HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
YQED Weighted:
0.79DETAILS
ALA3911124Name:
2-(2-([1,1'-biphenyl]-2-yl)vinyl)-4,5-dihydro-1H-imidazoleMol. Formula:
C17H16N2M.W.:
248.33Type:
Small moleculeAlogP:
3.37Polar Surface Area:
24.39HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.88DETAILS
ALA3904276Name:
N-((4,5-dihydro-1H-imidazol-2-yl)methyl)-2-methylanilineMol. Formula:
C11H15N3M.W.:
189.26Type:
Small moleculeAlogP:
1.41Polar Surface Area:
36.42HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
YQED Weighted:
0.75DETAILS- ALA3892351
Name:
N-((4,5-dihydro-1H-imidazol-2-yl)methyl)-2-propylanilineMol. Formula:
C13H19N3M.W.:
217.32Type:
Small moleculeAlogP:
2.05Polar Surface Area:
36.42HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.79DETAILS - ALA3582260
Name:
(S)-2-(1-(biphenyl-2-yl)propan-2-yl)-4,5-dihydro-1H-imidazoleMol. Formula:
C18H20N2M.W.:
264.37Type:
Small moleculeAlogP:
3.53Polar Surface Area:
24.39HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.90DETAILS - ALA3582259
Name:
(R)-2-(1-(biphenyl-2-yl)propan-2-yl)-4,5-dihydro-1H-imidazoleMol. Formula:
C18H20N2M.W.:
264.37Type:
Small moleculeAlogP:
3.53Polar Surface Area:
24.39HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.90DETAILS - ALA3408298
Name:
(E)-5-azido-2-chloro-4-iodo-N-(5-methylpyrrolidin-2-ylidene)anilineMol. Formula:
C11H11ClIN5M.W.:
375.60Type:
Small moleculeAlogP:
4.69Polar Surface Area:
73.15HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.35DETAILS - ALA3408297
Name:
5-((2-bromophenoxy)methyl)-4,5-dihydrooxazol-2-amineMol. Formula:
C10H11BrN2O2M.W.:
271.11Type:
Small moleculeAlogP:
1.54Polar Surface Area:
56.84HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.91DETAILS -
Type:
Small moleculeAlogP:
0.44Polar Surface Area:
62.44HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.63DETAILS - ALA3216207
Name:
(S)-2-(4,5-dihydro-1H-imidazol-5-yl)-N,N-dimethylethanamine dihydrochlorideMol. Formula:
C7H17Cl2N3M.W.:
214.14Type:
Small moleculeAlogP:
-0.06Polar Surface Area:
27.63HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
YQED Weighted:
0.60DETAILS -
Type:
Small moleculeAlogP:
1.42Polar Surface Area:
50.41HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.80DETAILS - ALA1644519
Name:
[4(5)S]-4(5)-(2-Aminoethyl)-2-(2-fluorophenyl)imidazoline dihydrobromideMol. Formula:
C11H15BrFN3M.W.:
288.16Type:
Small moleculeAlogP:
0.89Polar Surface Area:
50.41HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
YQED Weighted:
0.77DETAILS - ALA1644518
Name:
[4(5)S]-4(5)-(2-Aminoethyl)-2-phenylimidazoline dihydrobromideMol. Formula:
C11H16BrN3M.W.:
270.17Type:
Small moleculeAlogP:
0.75Polar Surface Area:
50.41HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
YQED Weighted:
0.74DETAILS -
Type:
Small moleculeAlogP:
2.41Polar Surface Area:
53.65HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.83DETAILS -
Type:
Small moleculeAlogP:
0.55Polar Surface Area:
68.87HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.82DETAILS -
Type:
Small moleculeAlogP:
0.55Polar Surface Area:
68.87HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.82DETAILS -
Type:
Small moleculeAlogP:
1.49Polar Surface Area:
59.64HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.86DETAILS -
Type:
Small moleculeAlogP:
1.49Polar Surface Area:
59.64HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.86DETAILS
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