Type:
UnknownAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
ALA70817Name:
(2-Aminomethyl-3H-benzoimidazol-5-yl)-cyclohex-3-enylmethyl-amineMol. Formula:
C15H20N4M.W.:
256.35Type:
Small moleculeAlogP:
2.79Polar Surface Area:
66.73HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.74DETAILS
ALA73117Name:
N-(2-Aminomethyl-3H-benzoimidazol-5-yl)-N-(2-benzyloxy-benzyl)-acetamideMol. Formula:
C24H24N4O2M.W.:
400.48Type:
Small moleculeAlogP:
4.15Polar Surface Area:
84.24HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.49DETAILS
ALA68529Name:
(2-Aminomethyl-1H-indol-5-yl)-(2-benzyloxy-benzyl)-amineMol. Formula:
C23H23N3OM.W.:
357.46Type:
Small moleculeAlogP:
4.82Polar Surface Area:
63.07HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.44DETAILS
Type:
Small moleculeAlogP:
-0.45Polar Surface Area:
38.05HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
YQED Weighted:
0.46DETAILS-
Type:
Small moleculeAlogP:
-1.51Polar Surface Area:
64.07HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.38DETAILS -
Type:
Small moleculeAlogP:
2.63Polar Surface Area:
66.73HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.67DETAILS - ALA70885
Name:
(2-Aminomethyl-3H-benzoimidazol-5-yl)-(4-benzyloxy-benzyl)-amineMol. Formula:
C22H22N4OM.W.:
358.44Type:
Small moleculeAlogP:
4.21Polar Surface Area:
75.96HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.46DETAILS - ALA71250
Name:
(2-Benzyloxy-benzyl)-(2-methyl-1H-benzoimidazol-5-yl)-amineMol. Formula:
C22H21N3OM.W.:
343.43Type:
Small moleculeAlogP:
5.06Polar Surface Area:
49.94HBA:
3HBD:
2#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.51DETAILS - ALA306862
Name:
N-(2-Aminomethyl-3H-benzoimidazol-5-yl)-2-benzyloxy-benzamideMol. Formula:
C22H20N4O2M.W.:
372.43Type:
Small moleculeAlogP:
3.85Polar Surface Area:
93.03HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.48DETAILS -
Type:
Small moleculeAlogP:
0.60Polar Surface Area:
80.72HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.54DETAILS - ALA71110
Name:
[5-(2-Benzyloxy-benzylamino)-1H-benzoimidazol-2-yl]-methanolMol. Formula:
C22H21N3O2M.W.:
359.43Type:
Small moleculeAlogP:
4.25Polar Surface Area:
70.17HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.46DETAILS - ALA70561
Name:
(2-Aminomethyl-3H-benzoimidazol-5-yl)-(2-phenylsulfanyl-benzyl)-amineMol. Formula:
C21H20N4SM.W.:
360.49Type:
Small moleculeAlogP:
4.78Polar Surface Area:
66.73HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.46DETAILS -
Type:
Small moleculeAlogP:
0.85Polar Surface Area:
52.04HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
YQED Weighted:
0.48DETAILS -
Type:
Small moleculeAlogP:
2.95Polar Surface Area:
83.80HBA:
3HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.64DETAILS - ALA73945
Name:
N-(2-Aminomethyl-3H-benzoimidazol-5-yl)-4-benzoyl-benzamideMol. Formula:
C22H18N4O2M.W.:
370.41Type:
Small moleculeAlogP:
3.50Polar Surface Area:
100.87HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.47DETAILS - ALA70273
Name:
N-(2-Aminomethyl-3H-benzoimidazol-5-yl)-3-((E)-pyridin-3-yl)-acrylamideMol. Formula:
C16H15N5OM.W.:
293.33Type:
Small moleculeAlogP:
2.07Polar Surface Area:
96.69HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.64DETAILS -
Type:
Small moleculeAlogP:
1.41Polar Surface Area:
41.99HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
YQED Weighted:
0.67DETAILS - ALA71547
Name:
N-[5-(2-Benzyloxy-benzylamino)-1H-benzoimidazol-2-ylmethyl]-acetamideMol. Formula:
C24H24N4O2M.W.:
400.48Type:
Small moleculeAlogP:
4.39Polar Surface Area:
79.04HBA:
4HBD:
3#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.41DETAILS -
Type:
Small moleculeAlogP:
1.79Polar Surface Area:
33.12HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
YQED Weighted:
0.70DETAILS
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