ALA3286625Name:
2,6-dichloro-N-(2,3-dimethyl-6-nitrophenylcarbamoyl)benzamideMol. Formula:
C16H13Cl2N3O4M.W.:
382.20Type:
Small moleculeAlogP:
4.48Polar Surface Area:
101.34HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.60DETAILS
ALA3286624Name:
4-(3-(5-bromo-2-hydroxybenzylideneamino)propyl)-1H-pyrazol-5(4H)-oneMol. Formula:
C13H14BrN3O2M.W.:
324.18Type:
Small moleculeAlogP:
2.09Polar Surface Area:
74.05HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.64DETAILS
ALA3286623Name:
2,4-dichloro-6-(((tetrahydrofuran-2-yl)methylimino)methyl)phenolMol. Formula:
C12H13Cl2NO2M.W.:
274.15Type:
Small moleculeAlogP:
3.30Polar Surface Area:
41.82HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.86DETAILS
ALA3286622Name:
2,4-dichloro-6-((2-hydroxyethylimino)methyl)phenolMol. Formula:
C9H9Cl2NO2M.W.:
234.08Type:
Small moleculeAlogP:
2.11Polar Surface Area:
52.82HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
YQED Weighted:
0.79DETAILS
Type:
Small moleculeAlogP:
7.06Polar Surface Area:
65.18HBA:
4HBD:
2#RO5 Violations:
1#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.43DETAILS- ALA3286620
Name:
4-(3-(3,5-dichloro-2-hydroxybenzylideneamino)propyl)-1H-pyrazol-5(4H)-oneMol. Formula:
C13H13Cl2N3O2M.W.:
314.17Type:
Small moleculeAlogP:
2.63Polar Surface Area:
74.05HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.65DETAILS
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