- ALA5282102
Name:
Show More⌵Mol. Formula:
C20H16ClN3O3S2M.W.:
445.95/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---AlogP:
3.83Polar Surface Area:
113.05HBA:
7HBD:
2#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.46DETAILS - ALA5286579
Name:
Show More⌵Mol. Formula:
C27H21Cl2N3O3S2M.W.:
570.52/*= $chembl['x_filter_bioactivities']*/?>/*= __("activity values")*/?>
/*=$chembl['x_filter_target_num']*/?>/*= __("unique targets")*/?>
Type:
---AlogP:
6.08Polar Surface Area:
104.26HBA:
7HBD:
1#RO5 Violations:
2#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.34DETAILS - ALA4554627
Name:
6,6'-(Ethane-1,2-diylbis(azanediyl))bis(methylene)dipicolinic acidMol. Formula:
C16H18N4O4M.W.:
330.34Type:
UnknownAlogP:
0.75Polar Surface Area:
124.44HBA:
6HBD:
4#RO5 Violations:
---#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.50DETAILS Type:
UnknownAlogP:
2.40Polar Surface Area:
152.30HBA:
12HBD:
2#RO5 Violations:
2#Rotatable Bonds:
12Passes Ro3:
NQED Weighted:
0.13DETAILSType:
Small moleculeAlogP:
3.40Polar Surface Area:
3.24HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.40DETAILS- ALA2296994
Name:
1-(1,3-Diphenylallylidene)-2-isonicotinohydrazoneMol. Formula:
C21H17N3OM.W.:
327.39Type:
Small moleculeAlogP:
3.93Polar Surface Area:
54.35HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.57DETAILS - ALA2296992
Name:
1-(1,3-diphenylallylidene)-(4-(1H-benzimidazol-2-yl)phenyl)hydrazoneMol. Formula:
C28H22N4M.W.:
414.51Type:
Small moleculeAlogP:
6.76Polar Surface Area:
53.07HBA:
3HBD:
2#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.24DETAILS - ALA2296991
Name:
1-(4-phenylbut-3-en-2-ylidene)-(4-(1H-benzimidazol-2-yl)phenyl)hydrazoneMol. Formula:
C23H20N4M.W.:
352.44Type:
Small moleculeAlogP:
5.73Polar Surface Area:
53.07HBA:
3HBD:
2#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.36DETAILS - ALA2296990
Name:
1-(1,3-diphenylallylidene)-(4-phenylthiazol-2-yl)hydrazoneMol. Formula:
C24H19N3SM.W.:
381.50Type:
Small moleculeAlogP:
6.34Polar Surface Area:
37.28HBA:
4HBD:
1#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.31DETAILS - ALA2296989
Name:
1-(4-phenylbut-3-en-2-ylidene)-(4-phenylthiazol-2-yl)hydrazoneMol. Formula:
C19H17N3SM.W.:
319.43Type:
Small moleculeAlogP:
5.31Polar Surface Area:
37.28HBA:
4HBD:
1#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.51DETAILS - ALA2296987
Name:
(4-benzylidene-2-methyloxazol-5(4H)-ylidene)-2-phenylhydrazoneMol. Formula:
C17H15N3OM.W.:
277.33Type:
Small moleculeAlogP:
3.90Polar Surface Area:
45.98HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.86DETAILS Type:
Small moleculeAlogP:
2.75Polar Surface Area:
34.14HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.33DETAILSType:
Small moleculeAlogP:
3.14Polar Surface Area:
34.14HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.32DETAILSType:
Small moleculeAlogP:
3.92Polar Surface Area:
34.14HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
11Passes Ro3:
NQED Weighted:
0.30DETAILSType:
Small moleculeAlogP:
-0.02Polar Surface Area:
103.83HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.48DETAILSType:
Small moleculeAlogP:
-0.02Polar Surface Area:
103.83HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.48DETAILSType:
Small moleculeAlogP:
-0.02Polar Surface Area:
103.83HBA:
5HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.48DETAILS