ALA147216Name:
2-(2-Dimethylamino-ethyl)-8-iodo-dibenzo[de,h]isoquinoline-1,3-dioneMol. Formula:
C20H17IN2O2M.W.:
444.27Type:
Small moleculeAlogP:
3.76Polar Surface Area:
40.62HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.35DETAILS
ALA147597Name:
9-Amino-2-(2-dimethylamino-ethyl)-dibenzo[de,h]isoquinoline-1,3-dioneMol. Formula:
C20H19N3O2M.W.:
333.39Type:
Small moleculeAlogP:
2.73Polar Surface Area:
66.64HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.45DETAILS
Type:
Small moleculeAlogP:
3.11Polar Surface Area:
69.72HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.56DETAILS
ALA146101Name:
10-Amino-2-(2-dimethylamino-ethyl)-dibenzo[de,h]isoquinoline-1,3-dioneMol. Formula:
C20H19N3O2M.W.:
333.39Type:
Small moleculeAlogP:
2.73Polar Surface Area:
66.64HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.45DETAILS
ALA148263Name:
2-(2-Dimethylamino-ethyl)-11-nitro-dibenzo[de,h]isoquinoline-1,3-dioneMol. Formula:
C20H17N3O4M.W.:
363.37Type:
Small moleculeAlogP:
3.06Polar Surface Area:
83.76HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.31DETAILS-
Type:
Small moleculeAlogP:
4.14Polar Surface Area:
69.72HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.51DETAILS - ALA145869
Name:
4-Amino-2-(2-dimethylamino-ethyl)-dibenzo[de,h]isoquinoline-1,3-dioneMol. Formula:
C20H19N3O2M.W.:
333.39Type:
Small moleculeAlogP:
2.73Polar Surface Area:
66.64HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.45DETAILS - ALA148027
Name:
11-Amino-2-(2-dimethylamino-ethyl)-dibenzo[de,h]isoquinoline-1,3-dioneMol. Formula:
C20H19N3O2M.W.:
333.39Type:
Small moleculeAlogP:
2.73Polar Surface Area:
66.64HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.45DETAILS -
Type:
Small moleculeAlogP:
3.11Polar Surface Area:
69.72HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.56DETAILS - ALA148141
Name:
2-(2-Dimethylamino-ethyl)-8-nitro-dibenzo[de,h]isoquinoline-1,3-dioneMol. Formula:
C20H17N3O4M.W.:
363.37Type:
Small moleculeAlogP:
3.06Polar Surface Area:
83.76HBA:
5HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.31DETAILS -
Type:
Small moleculeAlogP:
3.11Polar Surface Area:
69.72HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.56DETAILS - ALA147668
Name:
11-Acetyl-2-(2-dimethylamino-ethyl)-dibenzo[de,h]isoquinoline-1,3-dioneMol. Formula:
C22H20N2O3M.W.:
360.41Type:
Small moleculeAlogP:
3.35Polar Surface Area:
57.69HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.41DETAILS -
Type:
Small moleculeAlogP:
4.14Polar Surface Area:
69.72HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.51DETAILS
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