ALA3828179Name:
8-chloro-7-hydroxy-4-(trifluoromethyl)-2H-chromen-2-oneMol. Formula:
C10H4ClF3O3M.W.:
264.59Type:
Small moleculeAlogP:
3.17Polar Surface Area:
50.44HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.74DETAILS
Type:
Small moleculeAlogP:
2.66Polar Surface Area:
136.40HBA:
9HBD:
4#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.43DETAILS
Type:
Small moleculeAlogP:
2.66Polar Surface Area:
136.40HBA:
9HBD:
4#RO5 Violations:
---#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.43DETAILS
Type:
Small moleculeAlogP:
2.80Polar Surface Area:
136.40HBA:
9HBD:
4#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.45DETAILS
Type:
Small moleculeAlogP:
2.80Polar Surface Area:
136.40HBA:
9HBD:
4#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.45DETAILS-
Type:
Small moleculeAlogP:
2.41Polar Surface Area:
136.40HBA:
9HBD:
4#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.47DETAILS -
Type:
Small moleculeAlogP:
2.41Polar Surface Area:
136.40HBA:
9HBD:
4#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.47DETAILS -
Type:
Small moleculeAlogP:
3.41Polar Surface Area:
113.62HBA:
9HBD:
3#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.48DETAILS -
Type:
Small moleculeAlogP:
3.02Polar Surface Area:
113.62HBA:
9HBD:
3#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.49DETAILS -
Type:
Small moleculeAlogP:
2.66Polar Surface Area:
136.40HBA:
9HBD:
4#RO5 Violations:
---#Rotatable Bonds:
9Passes Ro3:
NQED Weighted:
0.40DETAILS - ALA3792620
Name:
2-(4,5,6,7-tetraiodo-1,3-dioxoisoindolin-2-yl)propanoic acidMol. Formula:
C11H5I4NO4M.W.:
722.78Type:
Small moleculeAlogP:
3.17Polar Surface Area:
74.68HBA:
3HBD:
1#RO5 Violations:
1#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.22DETAILS -
Type:
Small moleculeAlogP:
3.14Polar Surface Area:
112.41HBA:
6HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.67DETAILS -
Type:
Small moleculeAlogP:
4.81Polar Surface Area:
95.34HBA:
6HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.44DETAILS - ALA3793637
Name:
5-[(6-Methylthieno[2,3-d]pyrimidin-4-yl)amino]isophthalic acidMol. Formula:
C15H11N3O4SM.W.:
329.34Type:
Small moleculeAlogP:
3.14Polar Surface Area:
112.41HBA:
6HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.67DETAILS - ALA3793280
Name:
4-[(6-Methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acidMol. Formula:
C20H15N3O2SM.W.:
361.43Type:
Small moleculeAlogP:
5.11Polar Surface Area:
75.11HBA:
5HBD:
2#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.53DETAILS - ALA3794121
Name:
3-[(2-Methyl-6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acidMol. Formula:
C20H15N3O2SM.W.:
361.43Type:
Small moleculeAlogP:
5.11Polar Surface Area:
75.11HBA:
5HBD:
2#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.53DETAILS - ALA3792675
Name:
4-[(2-Methyl-6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acidMol. Formula:
C20H15N3O2SM.W.:
361.43Type:
Small moleculeAlogP:
5.11Polar Surface Area:
75.11HBA:
5HBD:
2#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.53DETAILS - ALA3793474
Name:
4-{[5-(4-Chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]amino}benzoic acidMol. Formula:
C19H12ClN3O2SM.W.:
381.84Type:
Small moleculeAlogP:
5.45Polar Surface Area:
75.11HBA:
5HBD:
2#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.49DETAILS - ALA3794291
Name:
3-[(6-Phenylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acidMol. Formula:
C19H13N3O2SM.W.:
347.40Type:
Small moleculeAlogP:
4.80Polar Surface Area:
75.11HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.55DETAILS - ALA3792630
Name:
3-[(5,6-Dimethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acidMol. Formula:
C15H13N3O2SM.W.:
299.36Type:
Small moleculeAlogP:
3.75Polar Surface Area:
75.11HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.77DETAILS
The page will load shortly, Thanks for your patience!
Select all
